input word = C00037568

Metabolite InformationStructural formula
Name O-Acetylgeniposidic acid
10-O-Acetylgeniposidic acid
Formula C18H24O11
Mw 416.13186161
CAS RN 169830-93-7
C_ID C00037568 ,
InChIKey GJCLXUNGVGZROH-FACFREDQNA-N
InChICode InChI=1S/C18H24O11/c1-7(20)26-5-8-2-3-9-10(16(24)25)6-27-17(12(8)9)29-18-15(23)14(22)13(21)11(4-19)28-18/h2,6,9,11-15,17-19,21-23H,3-5H2,1H3,(H,24,25)/t9-,11-,12-,13-,14+,15-,17+,18+/m1/s1
SMILES CC(=O)OCC1=CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlantaginaceaePlantago alpina Ref.
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