input word = C00032223

Metabolite InformationStructural formula
Name Sublanceoside C1
(+)-Sublanceoside C1
Cynajapogenin A 3-O-alpha-L-cymaropyranosyl-(1->4)-beta-D-digitoxopyranosyl-(1->4)-beta-D-digitoxopyranoside
Formula C39H58O13
Mw 734.38774194
CAS RN 923021-14-1
C_ID C00032223 ,
InChIKey FKGHOKMOXIJORP-CNNGBJFCNA-N
InChICode InChI=1S/C39H58O13/c1-18-23(11-12-46-18)24-9-10-26-25(36(24)44)8-7-22-13-30(29(42)17-39(22,26)5)50-32-14-27(40)37(20(3)48-32)51-33-15-28(41)38(21(4)49-33)52-34-16-31(45-6)35(43)19(2)47-34/h7,11-12,19-21,24-35,37-38,40-43H,8-10,13-17H2,1-6H3/t19-,20+,21+,24+,25+,26-,27-,28-,29+,30+,31+,32-,33-,34-,35-,37+,38+,39-/m0/s1
SMILES C1[C@@H](C(=O)[C@H]2[C@H](C1)[C@@]1(C(=CC2)C[C@H]([C@@H](C1)O)O[C@@H]1O[C@@H]([C@H]([C@H](C1)O)O[C@H]1C[C@@H]([C@@H]([C@H](O1)C)O[C@@H]1O[C@H]([C@@H]([C@@H](C1)OC)O)C)O)C)C)c1c(occ1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCynanchum sublanceolatum Ref.
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OrganismCynanchum sublanceolatum
ReferenceWarashina,Chem.Pharm.Bull.,54,(2006),1551