input word = C00042469

Metabolite InformationStructural formula
Name Devenyoside C
(-)-Devenyoside C
Formula C26H36O15
Mw 588.20542048
CAS RN 871904-62-0
C_ID C00042469 ,
InChIKey NUIRPZUDYHGACL-OMCSBCOQNA-N
InChICode InChI=1S/C26H36O15/c1-26(2,41-25-22(36)20(34)18(32)14(9-28)38-25)15(39-24-21(35)19(33)17(31)13(8-27)37-24)7-11-12(29)5-3-10-4-6-16(30)40-23(10)11/h3-6,13-15,17-22,24-25,27-29,31-36H,7-9H2,1-2H3/t13-,14-,15+,17+,18+,19+,20+,21-,22-,24+,25+/m1/s1
SMILES CC(C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](Cc1c(O)ccc2ccc(=O)oc12)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeSeseli devenyense Simonkai Ref.
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