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CHEBI:201292 - Chevalone D

ChEBI IDCHEBI:201292
ChEBI NameChevalone D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC27H40O5
Net Charge0
Average Mass444.612
Monoisotopic Mass444.28757
SMILESCC(=O)/C=C1/O[C@@]2(C)CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@@H]2CC1=O
InChIInChI=1S/C27H40O5/c1-16(28)14-19-18(30)15-22-26(6)11-8-20-24(3,4)23(31-17(2)29)10-12-25(20,5)21(26)9-13-27(22,7)32-19/h14,20-23H,8-13,15H2,1-7H3/b19-14+/t20-,21+,22-,23-,25-,26+,27-/m0/s1
InChIKeyZVXZSCMKLHUURH-XJFGCCAISA-N
Species of MetaboliteComponentSourceComments
Aspergillus chevalieri (ncbitaxon:182096) - DOI (10.1016/j.tet.2011.05.066)
ChEBI Ontology
Outgoing Relation(s)
Chevalone D (CHEBI:201292) is a organic heterotricyclic compound (CHEBI:26979)
Chevalone D (CHEBI:201292) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
[(2E,4aS,4bR,6aR,8S,10aR,10bR,12aS)-4b,7,7,10a,12a-pentamethyl-3-oxo-2-(2-oxopropylidene)-4a,5,6,6a,8,9,10,10b,11,12-decahydro-4H-naphtho[2,1-]chromen-8-yl] acetate
Manual XrefsDatabases
78436747ChemSpider