input word = C00058009

Metabolite InformationStructural formula
Name 3,5,9-Trihydroxyergost-7-en-6-one
Formula C28H46O4
Mw 446.33960996
CAS RN 211486-13-4
C_ID C00058009
InChIKey WNCDXWLLIJDSNA-ZFZPKPCHSA-N
InChICode InChI=1S/C28H46O4/c1-17(2)18(3)7-8-19(4)21-9-10-22-23-15-24(30)28(32)16-20(29)11-12-26(28,6)27(23,31)14-13-25(21,22)5/h15,17-22,29,31-32H,7-14,16H2,1-6H3/t18-,19+,20-,21+,22-,25+,26+,27+,28-/m0/s1
SMILES C[C@H](C(C)C)CC[C@@H](C)[C@@]1([H])CC[C@@]2([H])C3=CC([C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@@]3(O)CC[C@@]21C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPleurotaceaePleurotus ostreatus Ref.
FungiPolyporaceaeLentinus edodes Ref.
FungiStrophariaceaePholiota nameko Ref.
--Hypsizygus marmoreus Ref.
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OrganismPholiota nameko
ReferenceValisolalao, J. et al., Tetrahedron, 1983, 39, 2779-2785 (Polyporus versicolor metabs)