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CHEBI:224795 - Campafungin B

ChEBI IDCHEBI:224795
ChEBI NameCampafungin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H30O4
Net Charge0
Average Mass382.500
Monoisotopic Mass382.21441
SMILESC/C=C(\C)[C@@]1(O)[C@@H](/C=C/C=C/C=C/C=C/C(=O)O)[C@@H]2CC=C(C)C[C@H]2[C@@H]2O[C@@H]21
InChIInChI=1S/C24H30O4/c1-4-17(3)24(27)20(11-9-7-5-6-8-10-12-21(25)26)18-14-13-16(2)15-19(18)22-23(24)28-22/h4-13,18-20,22-23,27H,14-15H2,1-3H3,(H,25,26)/b7-5+,8-6+,11-9+,12-10+,17-4+/t18-,19-,20+,22+,23+,24-/m1/s1
InChIKeyQVAWIGOWYGZSNR-RURWRFGGSA-N
Species of MetaboliteComponentSourceComments
Plenodomus enteroleucus (ncbitaxon:1077365) - PubMed (32881504)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Campafungin B (CHEBI:224795) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name 
(2E,4E,6E,8E)-9-[(1aS,2S,3S,3aR,7aR,7bS)-2-[(E)-but-2-en-2-yl]-2-hydroxy-6-methyl-3,3a,4,7,7a,7b-hexahydro-1aH-naphtho[1,2-b]oxiren-3-yl]nona-2,4,6,8-tetraenoic acid