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CHEBI:226540 - Sterenoid I

ChEBI IDCHEBI:226540
ChEBI NameSterenoid I
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H50O3
Net Charge0
Average Mass458.727
Monoisotopic Mass458.37600
SMILESC[C@H](C/C=C/C(C)(C)O)[C@H]1CC[C@@]2(C)C3=C(C[C@H]2[C@]1(C)O)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
InChIInChI=1S/C30H50O3/c1-19(10-9-15-26(2,3)32)20-13-16-28(6)21-11-12-23-27(4,5)25(31)14-17-29(23,7)22(21)18-24(28)30(20,8)33/h9,15,19-20,23-25,31-33H,10-14,16-18H2,1-8H3/b15-9+/t19-,20-,23+,24-,25+,28+,29-,30-/m1/s1
InChIKeyDGYKMXWOZPFSKK-OGMKYOEBSA-N
Species of MetaboliteComponentSourceComments
Stereumspecies (ncbitaxon:1849817) - PubMed (29066792)
ChEBI Ontology
Outgoing Relation(s)
Sterenoid I (CHEBI:226540) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(3S,4aR,6bR,9R,10R,10aR,11bS)-9-[(E,2R)-6-hydroxy-6-methylhept-4-en-2-yl]-4,4,6b,10,11b-pentamethyl-2,3,4a,5,6,7,8,9,10a,11-decahydro-1H-benzo[a]luorene-3,10-diol
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