input word = C00056115

Metabolite InformationStructural formula
Name Schomburgkianone H
Formula C33H40O6
Mw 532.28248901
CAS RN 1960467-80-4
C_ID C00056115
InChIKey YQRXXSNOYPXXAH-HYARGMPZSA-N
InChICode InChI=1S/C33H40O6/c1-20(2)9-8-10-22(5)14-18-33(17-13-21(3)4)30(38)27(28(36)23-11-12-25(34)26(35)19-23)29(37)24-15-16-32(6,7)39-31(24)33/h9,11-16,19,34-35,38H,8,10,17-18H2,1-7H3/b22-14+
SMILES OC1=C(O)C=C(C(C2=C(O)C(C/C=C(C)/CC/C=C(C)C)(C/C=C(C)C)C(OC(C)(C)C=C3)=C3C2=O)=O)C=C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia schomburgkiana Ref.
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