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CHEBI:218662 - Valsafungin B

ChEBI IDCHEBI:218662
ChEBI NameValsafungin B
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SubmitterMetaboLights
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FormulaC19H36O4
Net Charge0
Average Mass328.493
Monoisotopic Mass328.26136
SMILESCCCCCCC(=O)CCCCCCCCC[C@H](CO)C(=O)O
InChIInChI=1S/C19H36O4/c1-2-3-4-11-14-18(21)15-12-9-7-5-6-8-10-13-17(16-20)19(22)23/h17,20H,2-16H2,1H3,(H,22,23)/t17-/m1/s1
InChIKeyYDYXWQYQAICUMA-QGZVFWFLSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Valsafungin B (CHEBI:218662) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(2R)-2-(hydroxymethyl)-12-oxooctadecanoic acid
Manual XrefsDatabases
78439439ChemSpider