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CHEBI:215553 - Tricholimbrin D

ChEBI IDCHEBI:215553
ChEBI NameTricholimbrin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H38O2
Net Charge0
Average Mass406.610
Monoisotopic Mass406.28718
SMILESCC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC(=O)[C@@H]2C3=C(CC[C@@]21C)[C@@]1(C)CCC=CC1=CC3=O
InChIInChI=1S/C28H38O2/c1-17(2)18(3)10-11-19(4)22-16-24(30)26-25-21(12-14-28(22,26)6)27(5)13-8-7-9-20(27)15-23(25)29/h7,9-11,15,17-19,22,26H,8,12-14,16H2,1-6H3/b11-10+/t18-,19+,22+,26+,27-,28+/m0/s1
InChIKeyNVNICJUFCWVJQN-KCEAIJKDSA-N
Species of MetaboliteComponentSourceComments
Tricholoma imbricatum (ncbitaxon:54538) - PubMed (32534274)
ChEBI Ontology
Outgoing Relation(s)
Tricholimbrin D (CHEBI:215553) is a cholestanoid (CHEBI:50401)
IUPAC Name 
(10S,13R,14S,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,11,12,14,16,17-hexahydro-1H-cyclopenta[a]phenanthrene-7,15-dione