input word = C00032552

Metabolite InformationStructural formula
Name Zizyberanalic acid
Colubrinic acid
Formula C30H46O4
Mw 470.33960996
CAS RN 67594-73-4
C_ID C00032552 ,
InChIKey SLWJVQQNDGLXTK-TUHGTJRKNA-N
InChICode InChI=1S/C30H46O4/c1-17(2)18-10-13-30(25(33)34)15-14-27(5)19(23(18)30)8-9-22-28(27,6)12-11-21-26(3,4)24(32)20(16-31)29(21,22)7/h16,18-24,32H,1,8-15H2,2-7H3,(H,33,34)/t18-,19+,20+,21-,22-,23-,24+,27+,28+,29-,30-/m0/s1
SMILES C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)[C@H](C=O)[C@@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaeColubrina granulosa Ref.
PlantaeRhamnaceaeZizyphus jujuba Ref.
--Zizphus cambodiana Ref.
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