input word = C00037303

Metabolite InformationStructural formula
Name Integrifoside B
(-)-Integrifoside B
Formula C21H36O8
Mw 416.24101813
CAS RN 266686-35-5
C_ID C00037303 ,
InChIKey YCBFPRSZKYUJNI-MUURVNNHNA-N
InChICode InChI=1S/C21H36O8/c1-10(2)11-7-14-20(3,8-12(11)23)6-5-15(21(14,4)27)29-19-18(26)17(25)16(24)13(9-22)28-19/h11-19,22-27H,1,5-9H2,2-4H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21-/m0/s1
SMILES C=C(C)[C@@H]1C[C@@H]2[C@](C)(CC[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@]2(C)O)C[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTessaria integrifolia Ruiz.et Pavon Ref.
PlantaeAsteraceaeTessaria integriforia Ref.
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OrganismTessaria integriforia
ReferenceOno, et al., Phytochemistry, 53, (2000), 479