input word = C00045177

Metabolite InformationStructural formula
Name 3,15-Dihydroxy-ent-labd-7-en-oic acid 3-O-beta-D-glucoside
(-)-3,15-Dihydroxy-ent-labd-7-en-oic acid 3-O-beta-D-glucoside
Formula C26H44O9
Mw 500.298533
CAS RN 436143-94-1
C_ID C00045177 ,
InChIKey LTEZVUVZFATCKC-FAIUAYMANA-N
InChICode InChI=1S/C26H44O9/c1-14(10-12-27)5-7-16-15(23(32)33)6-8-18-25(2,3)19(9-11-26(16,18)4)35-24-22(31)21(30)20(29)17(13-28)34-24/h6,14,16-22,24,27-31H,5,7-13H2,1-4H3,(H,32,33)/t14-,16+,17+,18+,19+,20+,21-,22+,24-,26+/m0/s1
SMILES CC(CCO)CC[C@@H]1C(C(=O)O)=CC[C@@H]2C(C)(C)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium glutinosum Ref.
zoom in