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CHEBI:226511 - Sterenoid C

ChEBI IDCHEBI:226511
ChEBI NameSterenoid C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H48O3
Net Charge0
Average Mass456.711
Monoisotopic Mass456.36035
SMILESCC(C)=CCC[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(C[C@H]2[C@]1(C)O)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1C[C@@H]3O
InChIInChI=1S/C30H48O3/c1-18(2)10-9-11-19(3)20-12-14-29(7)24(30(20,8)33)16-21-26(29)22(31)17-23-27(4,5)25(32)13-15-28(21,23)6/h10,19-20,22-24,31,33H,9,11-17H2,1-8H3/t19-,20-,22+,23+,24-,28-,29-,30-/m1/s1
InChIKeyBJUYSMDVUCQWSJ-HXIANIKISA-N
Species of MetaboliteComponentSourceComments
Stereumspecies (ncbitaxon:1849817) - PubMed (29066792)
ChEBI Ontology
Outgoing Relation(s)
Sterenoid C (CHEBI:226511) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(4aR,6S,6bR,9R,10R,10aR,11bS)-6,10-dihydroxy-4,4,6b,10,11b-pentamethyl-9-[(2R)-6-methylhept-5-en-2-yl]-1,2,4a,5,6,7,8,9,10a,11-decahydrobenzo[a]luoren-3-one
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78441588ChemSpider