input word = C00045143

Metabolite InformationStructural formula
Name Zizyvoside I
Formula C25H40O12
Mw 532.25197674
CAS RN 81425-28-7
C_ID C00045143 ,
InChIKey SWOFNYOUVWQWHE-RUROELMINA-N
InChICode InChI=1S/C25H40O12/c1-11-8-14(27)9-24(4,5)25(11,33)7-6-12(2)34-23-21(19(31)17(29)15(10-26)36-23)37-22-20(32)18(30)16(28)13(3)35-22/h6-8,12-13,15-23,26,28-33H,9-10H2,1-5H3/b7-6+/t12-,13+,15-,16+,17-,18-,19+,20-,21-,22+,23-,25-/m1/s1
SMILES CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDioscoreaceaeDioscorea spongiosa Ref.
PlantaeRhamnaceaeZiziphus jujuba var.inermis Ref.
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OrganismZiziphus jujuba var.inermis
ReferenceYin, et al., Modern Study of Chinese Drugs and Clinical Applications (1), Xueyuan Press, Beijing, (1993).

Yin, et al., JNP, 66, (2003), 646