input word = C00029581

Metabolite InformationStructural formula
Name 6'-O-(E-4-Hydroxycinnamoyl)-desglucouzarin
Formula C38H50O11
Mw 682.33531244
CAS RN 140400-62-0
C_ID C00029581 ,
InChIKey UXTGZQCKFDJZIH-BJMVGYQFNA-N
InChICode InChI=1S/C38H50O11/c1-36-14-11-25(48-35-34(44)33(43)32(42)29(49-35)20-47-30(40)10-5-21-3-7-24(39)8-4-21)18-23(36)6-9-28-27(36)12-15-37(2)26(13-16-38(28,37)45)22-17-31(41)46-19-22/h3-5,7-8,10,17,23,25-29,32-35,39,42-45H,6,9,11-16,18-20H2,1-2H3/b10-5+/t23-,25-,26-,27+,28-,29-,32-,33+,34+,35-,36+,37-,38+/m0/s1
SMILES CC12CCC(OC3OC(COC(=O)/C=C/c4ccc(O)cc4)C(O)C(O)C3O)CC1CCC1C2CCC2(C)C(C3=CC(=O)OC3)CCC12O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAsclepias curassavica L. Ref.
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