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CHEBI:207785 - Cryptophomic acid

ChEBI IDCHEBI:207785
ChEBI NameCryptophomic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC9H10Cl2O4
Net Charge0
Average Mass253.081
Monoisotopic Mass251.99561
SMILESC/C=C/C1=C(Cl)[C@@H](O)[C@@H](Cl)[C@@]1(O)C(=O)O
InChIInChI=1S/C9H10Cl2O4/c1-2-3-4-5(10)6(12)7(11)9(4,15)8(13)14/h2-3,6-7,12,15H,1H3,(H,13,14)/b3-2+/t6-,7-,9-/m1/s1
InChIKeyCQCJNRAGFPJOFU-HQTIMQCISA-N
Species of MetaboliteComponentSourceComments
Phoma (ncbitaxon:37463) - DOI (10.1007/s00044-018-2201-1)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Cryptophomic acid (CHEBI:207785) is a hydroxy monocarboxylic acid (CHEBI:35868)
IUPAC Name 
(1S,4S,5R)-3,5-dichloro-1,4-dihydroxy-2-[(E)-prop-1-enyl]cyclopent-2-ene-1-carboxylic acid
Manual XrefsDatabases
70951806ChemSpider