input word = C00020000

Metabolite InformationStructural formula
Name Peujaponiside
Formula C25H34O14
Mw 558.1948558
CAS RN 155740-16-2
C_ID C00020000 ,
InChIKey DVLIAXKBIVLBKD-JFKOKLHGNA-N
InChICode InChI=1S/C25H34O14/c1-24(2,33)16(27)6-12-5-11-3-4-17(28)37-13(11)7-14(12)38-22-20(31)19(30)18(29)15(39-22)8-35-23-21(32)25(34,9-26)10-36-23/h3-5,7,15-16,18-23,26-27,29-34H,6,8-10H2,1-2H3/t15-,16+,18-,19+,20-,21+,22-,23-,25+/m1/s1
SMILES CC(C)(O)C(O)Cc1cc2ccc(=O)oc2cc1O[C@@H]1OC(CO[C@@H]2OC[C@@](O)(CO)C2O)[C@@H](O)[C@H](O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaePeucedanum japonicum Ref.
zoom in