Consensus flow list

Identity

Type
Neutral molecule
CAS
42835-25-6
EC
255-962-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Flumequine

What it is used for

1

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
environmental contaminant CHEBI:78298 Any minor or unwanted substance introduced into the environment that can have undesired effects. ChEBI

Alternative labels

15

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string DPSPPJIUMHPXMA-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C14H12FNO3/c1-7-2-3-8-4-9(15)5-10-12(8)16(7)6-11(13(10)17)14(18)19/h4-7H,2-3H2,1H3,(H,18,19)
IUPAC name chemrof:IUPAC_name 9-Fluoro-6,7-dihydro-5-methyl-1-oxo-1H,5H-benzo(ij)quinolizine-2-carboxylic acid
Molecular formula chemrof:molecular_formula C14H12FNO3
Molecular mass chemrof:molecular_mass 261.252
Monoisotopic mass chemrof:monoisotopic_mass 261.080121
SMILES string chemrof:smiles_string CC1CCc2cc(F)cc3c(=O)c(C(=O)O)cn1c23

Known URLs

12

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
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=42835-25-6 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:85267 enrich_references.chebi_id_link
KEGG https://www.genome.jp/entry/D02302 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23773949 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24261869 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24836135 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/25045079 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/25476307 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/25633214 enrich_references.chebi_xrefs
reaxys reaxys:490724 enrich_references.chebi_xrefs
vsdb vsdb:1564 enrich_references.chebi_xrefs
Wikipedia https://en.wikipedia.org/wiki/Flumequine enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
c48a4063-f2f2-4f14-902c-e88e6d18893f Environmental → Air → Aircraft cruise height EF 3.1 kg 2
083247cf-365f-40d9-9637-11f2a2489a52 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
719e5276-5a39-45ff-8a26-52f71c0a51c5 Environmental → Air → Indoor EF 3.1 kg 2
23d73215-c86a-42f7-91be-7547938c7286 Environmental → Air → Long-term EF 3.1 kg 0
58afddb2-264d-4bfc-8552-6e6adec59ffe Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
095ac59b-13f7-4528-aa48-35d1fb3fde02 Environmental → Air → Unknown EF 3.1 kg 2
e1b5e608-fed4-43e5-8b1d-2149ea74e4af Environmental → Ground → Agricultural EF 3.1 kg 2
6d4a0db6-fbc1-43b3-8237-90882b57e7a3 Environmental → Ground → Non-agricultural EF 3.1 kg 2
9ffb6433-591f-48ac-81a6-969bd0f2ee24 Environmental → Ground → Unknown EF 3.1 kg 2
96135f12-f305-4988-bd4b-50c3f906e6c7 Environmental → Water → Long-term EF 3.1 kg 0
bab5090c-3c2f-4bda-8b6d-1c6b7ecf13bb Environmental → Water → Ocean EF 3.1 kg 2
b0e32dbd-6c2b-4311-9afc-a6bd85e806ef Environmental → Water → Surface water EF 3.1 kg 2
6fa50d1c-4672-49f0-80c0-1a52db94af50 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-ef2fdee3958b1de5",
  "prefLabel": [
    {
      "@value": "Flumequine",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "(±)-Flumequine",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1H,5H-Benzo[ij]quinolizine-2-carboxylic acid, 9-fluoro-6,7-dihydro-5-methyl-1-oxo-",
      "@language": "en",
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      "@value": "Apurone",
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    {
      "@value": "Fantacin",
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    {
      "@value": "Firestop",
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    },
    {
      "@value": "flumequino",
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    },
    {
      "@value": "Flumigal",
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    },
    {
      "@value": "Flumiquil",
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    },
    {
      "@value": "Flumisol",
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    },
    {
      "@value": "Flumix",
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    },
    {
      "@value": "Imequyl",
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    {
      "@value": "rac-9-fluoro-5-methyl-1-oxo-6,7-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-2-carboxylic acid",
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  "properties": {
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        "prov:wasDerivedFrom": "http://semanticscience.org/resource/CHEMINF_000446 -> ChEBI RO:0000087"
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    }
  ]
}

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