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CHEBI:206102 - Acremolactone C

ChEBI IDCHEBI:206102
ChEBI NameAcremolactone C
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FormulaC26H32O7
Net Charge0
Average Mass456.535
Monoisotopic Mass456.21480
SMILESCCC/C=C(\C)[C@@H](O)[C@H]1C(=O)O[C@@]2(C)[C@@H]1C1=C(C[C@@H]2O)C(=O)[C@@](O)(c2ccccc2C)[C@H]1O
InChIInChI=1S/C26H32O7/c1-5-6-9-14(3)21(28)19-20-18-15(12-17(27)25(20,4)33-24(19)31)22(29)26(32,23(18)30)16-11-8-7-10-13(16)2/h7-11,17,19-21,23,27-28,30,32H,5-6,12H2,1-4H3/b14-9+/t17-,19-,20+,21+,23-,25+,26-/m0/s1
InChIKeyWFSQOASGVQNLMJ-VCFCRMMKSA-N
Species of MetaboliteComponentSourceComments
Acremonium (ncbitaxon:159075) - PubMed (15618640)
ChEBI Ontology
Outgoing Relation(s)
Acremolactone C (CHEBI:206102) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
(1S,3aS,4S,7R,8S,8bS)-4,7,8-trihydroxy-1-[(E,1S)-1-hydroxy-2-methylhex-2-enyl]-3a-methyl-7-(2-methylphenyl)-4,5,8,8b-tetrahydro-1H-cyclopenta[e][1]benzouran-2,6-dione
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