input word = C00046377

Metabolite InformationStructural formula
Name Sandorinic acid C
(+)-Sandorinic acid C
Formula C30H46O4
Mw 470.33960996
CAS RN 369647-36-9
C_ID C00046377 ,
InChIKey ARUDPAROWGJVLG-FQDYXOSPNA-N
InChICode InChI=1S/C30H46O4/c1-25(2)20-9-8-18-19(28(20,5)11-10-22(25)31)16-23(32)30(7)21-17-27(4,24(33)34)13-12-26(21,3)14-15-29(18,30)6/h20-21,23,32H,8-17H2,1-7H3,(H,33,34)/t20-,21+,23+,26+,27+,28+,29+,30+/m0/s1
SMILES CC1(C)C(=O)CC[C@]2(C)C3=C(CC[C@@H]12)[C@@]1(C)CC[C@@]2(C)CC[C@@](C)(C(=O)O)C[C@H]2[C@]1(C)[C@H](O)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeSandoricum indicum Ref.
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