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CHEBI:205652 - Polyporoid C

ChEBI IDCHEBI:205652
ChEBI NamePolyporoid C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H46O7
Net Charge0
Average Mass494.669
Monoisotopic Mass494.32435
SMILESCC(C)C(C)C[C@@H](O)[C@](C)(O)[C@H]1[C@@H](O)C[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
InChIInChI=1S/C28H46O7/c1-14(2)15(3)9-23(33)27(6,34)24-22(32)13-28(35)17-10-19(29)18-11-20(30)21(31)12-25(18,4)16(17)7-8-26(24,28)5/h10,14-16,18,20-24,30-35H,7-9,11-13H2,1-6H3/t15?,16-,18-,20+,21-,22-,23+,24-,25+,26+,27-,28+/m0/s1
InChIKeyRVRAYMBCPTYQKZ-UFOPSCFWSA-N
Species of MetaboliteComponentSourceComments
Polyporus umbellatus (ncbitaxon:158314) - PubMed (18439824)
ChEBI Ontology
Outgoing Relation(s)
Polyporoid C (CHEBI:205652) is a steroid (CHEBI:35341)
IUPAC Name 
(2S,3R,5R,9R,10R,13R,14S,16S,17R)-17-[(2R,3R)-2,3-dihydroxy-5,6-dimethylheptan-2-yl]-2,3,14,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
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