input word = C00023762

Metabolite InformationStructural formula
Name Portensterol
Hydroxyisoergosterol
Formula C28H44O2
Mw 412.33413065
CAS RN 62005-66-7
C_ID C00023762 ,
InChIKey RJWIGXOAUROSSK-MVXHJBJBNA-N
InChICode InChI=1S/C28H44O2/c1-17(2)18(3)7-8-19(4)23-11-12-24-22-10-9-20-15-21(29)13-14-27(20,5)26(22)25(30)16-28(23,24)6/h7-9,17-19,21,23-25,29-30H,10-16H2,1-6H3/b8-7+/t18-,19+,21-,23-,24+,25+,27+,28+/m0/s1
SMILES C1[C@@H](CC2=CCC3=C([C@@]2(C1)C)[C@@H](C[C@]1([C@@H]3CC[C@H]1[C@@H](/C=C/[C@@H](C(C)C)C)C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTricholomataceaeClitocybe nebularis Ref.
FungiTricholomataceaeTricholoma portentosum Ref.
--Clytocybe nebularis Ref.
--Rhodopaxillus nudus Ref.
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