input word = C00050959

Metabolite InformationStructural formula
Name Isomultiflorenyl acetate
Formula C32H52O2
Mw 468.3967309
CAS RN 22611-25-2
C_ID C00050959
InChIKey IQPSCJJRYFMIOC-ZJHZAFJQNA-N
InChICode InChI=1S/C32H52O2/c1-21(33)34-26-13-14-30(7)22-12-15-32(9)25-20-27(2,3)16-17-29(25,6)18-19-31(32,8)23(22)10-11-24(30)28(26,4)5/h24-26H,10-20H2,1-9H3/t24-,25+,26-,29+,30+,31+,32-/m0/s1
SMILES CC(=O)O[C@H]1CC[C@]2(C)C3=C(CC[C@H]2C1(C)C)[C@@]1(C)CC[C@@]2(C)CCC(C)(C)C[C@H]2[C@]1(C)CC3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeBenincasa cerifera Ref.
PlantaeCucurbitaceaeBenincasa hispida Ref.
zoom in



OrganismBenincasa hispida
ReferenceChinese Materia Medica Editing Committee of the National Chinese Medicine and Pharmacology Bureau, Chinese Materia Medica (ZHONG HUA BEN CAO), Vol.1-Vol.30, Shanghai Science and technology Press, Shanghai, (1999)