input word = C00031312

Metabolite InformationStructural formula
Name Schisanlactone A
Formula C30H40O4
Mw 464.29265977
CAS RN 87164-31-6
C_ID C00031312 ,
InChIKey VJNOAOVMGNCSPJ-UHFFFAOYNA-N
InChICode InChI=1S/C30H40O4/c1-18-7-11-25(33-27(18)32)19(2)22-14-16-30(6)24-10-9-23-20(8-12-26(31)34-28(23,3)4)17-21(24)13-15-29(22,30)5/h7-8,12,17,19,22-23,25H,9-11,13-16H2,1-6H3/t19-,22+,23+,25+,29+,30-/m0/s1
SMILES C1=CC2=CC3=C(CC[C@H]2C(OC1=O)(C)C)[C@]1([C@](CC3)([C@H](CC1)[C@@H]([C@@H]1OC(=O)C(=CC1)C)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiGanodermataceaeGanoderma colossum (FR.) C.F.BAKER Ref.
--kadsura peltigera Ref.
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