input word = C00010773

Metabolite InformationStructural formula
Name Laciniatoside V
Formula C27H38O14
Mw 586.22615592
CAS RN 120416-05-9
C_ID C00010773 ,
InChIKey MXXRZVWQIBOVFZ-LOARGWCSNA-N
InChICode InChI=1S/C27H38O14/c1-4-12-13(5-6-28)15(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)24(34)39-17-7-14-16(23(33)36-3)9-37-25(35)19(14)11(17)2/h4,9-14,17-22,25-32,35H,1,5-8H2,2-3H3/t11-,12-,13-,14+,17-,18+,19-,20+,21-,22-,25+,26-,27-/m0/s1
SMILES [C@@H]1([C@@H]([C@@H](OC=C1C(=O)O[C@H]1C[C@H]2[C@H]([C@H]1C)[C@@H](OC=C2C(=O)OC)O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@@H]1O)O)O)CO)C=C)CCO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDipsacaceae/Diervillaceae/Linnaeaceae/ValerianaceaeDipsacus laciniatus Ref.
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