input word = C00036551

Metabolite InformationStructural formula
Name 3-Hydroxyvibsanin E
Formula C25H36O6
Mw 432.25118888
CAS RN 219796-69-7
C_ID C00036551 ,
InChIKey VKHACZXOCHJKOR-MEWKJORGNA-N
InChICode InChI=1S/C25H36O6/c1-15(2)11-21(27)30-10-8-18-17(12-16(3)26)22(28)25(29)14-31-23(4,5)19-7-9-24(18,6)13-20(19)25/h8,10-11,17-20,29H,7,9,12-14H2,1-6H3/b10-8+/t17-,18-,19+,20-,24-,25-/m0/s1
SMILES CC(=O)C[C@@H]1C(=O)[C@]2(O)COC(C)(C)[C@@H]3CC[C@@](C)(C[C@@H]32)[C@H]1/C=C/OC(=O)C=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAdoxaceaeViburnum suspensum Ref.
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