input word = C00031715

Metabolite InformationStructural formula
Name Cynanchogenin
Formula C28H42O6
Mw 474.29813907
CAS RN 6870-10-6
C_ID C00031715 ,
InChIKey SZUXICHIYZJLOY-GHRIWEEINA-N
InChICode InChI=1S/C28H42O6/c1-16(2)17(3)13-24(31)34-23-15-22-25(5)10-8-20(30)14-19(25)7-11-27(22,32)28(33)12-9-21(18(4)29)26(23,28)6/h7,13,16,20-23,30,32-33H,8-12,14-15H2,1-6H3/b17-13+/t20-,21+,22-,23-,25+,26+,27+,28-/m1/s1
SMILES C1[C@H](CC2=CC[C@@]3([C@@H]([C@]2(C1)C)C[C@H]([C@]1([C@@]3(CC[C@H]1C(=O)C)O)C)OC(=O)/C=C(/C(C)C)\C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAraujia sericifera Ref.
PlantaeApocynaceaeCynanchum caudatum Max. Ref.
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