input word = C00055426

Metabolite InformationStructural formula
Name Chikusetsusaponin L10
Formula C36H62O9
Mw 638.43938358
CAS RN 63223-87-0
C_ID C00055426
InChIKey AFXRHCWVBQOWMP-OBKCBSRTSA-N
InChICode InChI=1S/C36H62O9/c1-19(2)10-9-13-36(8,43)20-11-15-34(6)26(20)22(44-31-29(42)28(41)27(40)23(18-37)45-31)16-24-33(5)14-12-25(39)32(3,4)30(33)21(38)17-35(24,34)7/h10,20-31,37-43H,9,11-18H2,1-8H3/t20-,21-,22+,23+,24+,25-,26-,27+,28-,29+,30-,31+,33+,34+,35+,36-/m0/s1
SMILES O[C@](CC/C=C(C)/C)(C)[C@@]1([H])CC[C@@]2(C)[C@]3(C)C[C@H](O)[C@@]4([H])C(C)(C)[C@@H](O)CC[C@]4(C)[C@@]3([H])C[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O5)[C@@]21[H]
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax japonicus Ref.
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