input word = C00034013

Metabolite InformationStructural formula
Name Lactoside B
Formula C25H34O11
Mw 510.21011193
CAS RN 152340-66-4
C_ID C00034013 ,
InChIKey WXRVPRKVIDFJHO-GGICDANHNA-N
InChICode InChI=1S/C25H34O11/c1-9(2)19-14-11(5-13(27)35-19)24(3)6-10(7-25(4)21(24)20(16(14)29)36-23(25)32)33-22-18(31)17(30)15(28)12(8-26)34-22/h5,9-10,12,15-18,20-22,26,28-31H,6-8H2,1-4H3/t10-,12-,15-,16-,17+,18-,20-,21-,22-,24-,25+/m1/s1
SMILES [C@H]12[C@]3(c4c([C@H]([C@H]1OC(=O)[C@]2(C[C@@H](C3)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C)O)c(C(C)C)oc(=O)c4)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeLactuca laciniata Roth Ref.
PlantaeAsteraceaeNotoseris gracilipes C. Shih Ref.
PlantaeAsteraceaeNotoseris psilolepis C. Shih Ref.
zoom in