input word = C00064648

Metabolite InformationStructural formula
Name Cynatratoside A
Formula C28H40O8
Mw 504.27231825
CAS RN 97399-96-7
C_ID C00064648
InChIKey QANVGLGBLJFUIP-UHFFFAOYSA-N
InChICode InChI=1S/C28H40O8/c1-15-25(29)21(31-4)12-23(34-15)35-18-9-10-27(2)17(11-18)6-7-19-20(27)8-5-16-13-32-28(3)24(16)22(14-33-28)36-26(19)30/h6,13,15,18-25,29H,5,7-12,14H2,1-4H3
SMILES COC1CC(OC2CCC3(C)C(=CCC4C(=O)OC5COC6(C)OC=C(CCC43)C56)C2)OC(C)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeStrobilanthes cusia Ref.
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