Consensus flow list

Natamycin

fo-60d244efb5a7854e

Identity

Type
NeutralMolecule
CAS
7681-93-8
EC
231-683-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Natamycin

This substance carries 2 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.

What it is used for

3

Roles, not types. A substance bears as many as apply — sulfluramid is an insecticide and an acaricide — and each is a class ChEBI curates, asserted with ChEBI’s own has role. The narrow ones publish the broad ones alongside them, so a substance filed as a herbicide is a pesticide here too. See agricultural chemicals for what the axis is and which classes are published.

Role Definition Evidence
agrochemical CHEBI:33286 An agrochemical is a substance that is used in agriculture or horticulture. ChEBI
fungicide CHEBI:24127 A substance used to destroy fungal pests. ChEBI
pesticide CHEBI:25944 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. ChEBI

Alternative labels

34

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string NCXMLFZGDNKEPB-BQGNJOPGSA-N, NCXMLFZGDNKEPB-FFPOYIOWSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C33H47NO13/c1-18-10-8-6-4-3-5-7-9-11-21(45-32-30(39)28(34)29(38)19(2)44-32)15-25-27(31(40)41)22(36)17-33(42,47-25)16-20(35)14-24-23(46-24)12-13-26(37)43-18/h3-9,11-13,18-25,27-30,32,35-36,38-39,42H,10,14-17,34H2,1-2H3,(H,40,41)/b4-3+,7-5+,8-6+,11-9+,13-12+/t18-,19-,20+,21+,22+,23-,24-,25+,27-,28+,29-,30+,32+,33-/m1/s1
Isomeric SMILES string chemrof:isomeric_smiles_string C[C@@H]1C/C=C/C=C/C=C/C=C/[C@H](O[C@@H]2O[C@H](C)[C@@H](O)[C@H](N)[C@@H]2O)C[C@@H]2O[C@](O)(C[C@@H](O)C[C@H]3O[C@@H]3/C=C/C(=O)O1)C[C@H](O)[C@H]2C(=O)O
IUPAC name chemrof:IUPAC_name (1R,3S,5R,7R,8E,12R,14E,16E,18E,20E,22R,24S,25R,26S)-22-[(3-amino-3,6-dideoxy-beta-D-mannopyranosyl)oxy]-1,3,26-trihydroxy-12-methyl-10-oxo-6,11,28-trioxatricyclo[22.3.1.0(5,7)]octacosa-8,14,16,18,20-pentaene-25-carboxylic acid
Molecular formula chemrof:molecular_formula C33H47NO13
Molecular mass chemrof:molecular_mass 665.733
Monoisotopic mass chemrof:monoisotopic_mass 665.30474, 665.304741
SMILES string chemrof:smiles_string CC1CC=CC=CC=CC=CC(OC2OC(C)C(O)C(N)C2O)CC2OC(O)(CC(O)CC3OC3C=CC(=O)O1)CC(O)C2C(=O)O

Known URLs

40

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
agr agr:IND607246306 enrich_references.chebi_xrefs
agr agr:IND607253996 enrich_references.chebi_xrefs
bpdb bpdb:2062 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=7681-93-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:7488 enrich_references.chebi_id_link
ChemSpider https://www.chemspider.com/Chemical-Structure.10468784.html enrich_references.chebi_xrefs
DrugBank https://go.drugbank.com/drugs/DB00826 enrich_references.chebi_xrefs
drugcentral drugcentral:1885 enrich_references.chebi_xrefs
foodb.food foodb.food:FDB002337 enrich_references.chebi_xrefs
glycosmos.org https://glycosmos.org/glycans/show/G24506MP enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0014964 enrich_references.chebi_xrefs
KEGG https://www.genome.jp/entry/C08073 enrich_references.chebi_xrefs
KEGG https://www.genome.jp/entry/D00884 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C08073 enrich_references.pubchem_identifier_url
MetaCyc https://metacyc.org/compound?orgid=META&id=CPD-17213 enrich_references.chebi_xrefs
pesticides pesticides:natamycin enrich_references.chebi_xrefs
pharmgkb.org https://www.pharmgkb.org/chemical/PA164744325 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/5281099 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/18165687 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/30562337 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/31311527 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/32382679 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/32650062 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/32891143 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33306429 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33320038 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33653522 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33737097 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33748084 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33822660 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33882328 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33973428 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34085850 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34311233 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34428517 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34515597 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34571612 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34574183 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q248466 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Natamycin enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
1bc19a9a-ba04-440a-9e85-331cc3511316 Environmental → Air → Aircraft cruise height EF 3.1 kg 0
d97aa9c7-0b22-4ffd-939f-187862c48193 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 0
eb50a2ee-9bea-4801-9e64-35ac7c591cec Environmental → Air → Indoor EF 3.1 kg 0
03dea1e5-5cb7-476a-b704-ca921f7bd8c9 Environmental → Air → Long-term EF 3.1 kg 0
589350b4-34ce-4be4-9e3d-c50f15988a6b Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 0
83849fb9-f6f5-497c-82da-766ddc1b9899 Environmental → Air → Unknown EF 3.1 kg 0
59149e58-bf7f-4899-8bd1-dc18fa532d3f Environmental → Ground → Agricultural EF 3.1 kg 0
bc00a3ed-d99d-4b7e-ab5c-7503447c5295 Environmental → Ground → Non-agricultural EF 3.1 kg 0
b7084af9-3424-4628-9043-32c0f12eafd4 Environmental → Ground → Unknown EF 3.1 kg 0
f6c257f3-05e2-4280-a544-65361394d9a1 Environmental → Water → Long-term EF 3.1 kg 0
a8527fd2-3cb0-44d3-94b6-959849f3b1d1 Environmental → Water → Ocean EF 3.1 kg 0
afa019e3-ca43-4088-a3af-8772f8fa54fc Environmental → Water → Surface water EF 3.1 kg 0
dcd1ba25-9470-4672-814d-5ca400a7e57f Environmental → Water → Unknown EF 3.1 kg 0

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON 
{
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  "altLabel": [
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      "@value": "(1R,3S,5R,7R,8E,12R,14E,16E,18E,20E,22R,24S,25R,26S)-22-[(3-Amino-3,6-dideoxy-β-D-mannopyranosyl)oxy]-1,3,26-trihydroxy-12-methyl-10-oxo-6,11,28-trioxatricyclo[22.3.1.05,7]octacosa-8,14,16,18,20-pentaene-25-carboxylic acid",
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    },
    {
      "@value": "Antibiotic A 5283",
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    },
    {
      "@value": "Ceramax FS 150",
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    },
    {
      "@value": "CL 12,625",
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    },
    {
      "@value": "Delvocid",
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    },
    {
      "@value": "Delvolan",
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    },
    {
      "@value": "Delvopos",
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      }
    },
    {
      "@value": "Fungin",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "MeSH ID: D010866",
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      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Mycophyt",
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      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Myprozine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
      "@value": "Myuprozine",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Natacyn",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Natajen",
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      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Natamatrix",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "http://purl.obolibrary.org/obo/CHEBI_7488"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Natamax",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "http://purl.obolibrary.org/obo/CHEBI_7488"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Natamax lactose",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:7681-93-8",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=7681-93-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Natamax SF",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=7681-93-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "natamicina",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "http://purl.obolibrary.org/obo/CHEBI_7488"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "natamycine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "http://purl.obolibrary.org/obo/CHEBI_7488"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "natamycinum",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Pimafucin",
      "@language": "en",
      "@lang": "en",
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