input word = C00051133

Metabolite InformationStructural formula
Name Karounidiol 3-benzoate
Formula C37H52O3
Mw 544.39164553
CAS RN 118117-32-1
C_ID C00051133
InChIKey QTSNHJFHQLIOGA-GFOJEQLTNA-N
InChICode InChI=1S/C37H52O3/c1-32(2)28-14-13-27-26(35(28,5)17-16-30(32)40-31(39)25-11-9-8-10-12-25)15-18-37(7)29-23-33(3,24-38)19-20-34(29,4)21-22-36(27,37)6/h8-13,15,28-30,38H,14,16-24H2,1-7H3/t28-,29+,30+,33+,34+,35+,36+,37-/m0/s1
SMILES CC1(C)[C@H](OC(=O)c2ccccc2)CC[C@]2(C)C3=CC[C@@]4(C)[C@@H]5C[C@](C)(CO)CC[C@]5(C)CC[C@]4(C)C3=CC[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeTrichosanthes korilowii Ref.
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