input word = C00059644

Metabolite InformationStructural formula
Name Populnilic acid
Formula C30H48O4
Mw 472.35526002
CAS RN 131917-15-2
C_ID C00059644
InChIKey SWVZUKMWVDSFBK-VWNVZTIHSA-N
InChICode InChI=1S/C30H48O4/c1-18-23(32)19(31)16-21-27(18,4)9-8-20-28(21,5)13-15-30(7)22-17-26(3,24(33)34)11-10-25(22,2)12-14-29(20,30)6/h18,20-23,32H,8-17H2,1-7H3,(H,33,34)/t18-,20-,21+,22+,23+,25+,26+,27+,28+,29+,30-/m0/s1
SMILES CC1C(O)C(=O)CC2C1(C)CCC1C2(C)CCC2(C)C3CC(C)(C(=O)O)CCC3(C)CCC12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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