input word = C00047236

Metabolite InformationStructural formula
Name Gambogenific acid
(-)-Gambogenific acid
Formula C38H46O9
Mw 646.31418307
CAS RN 1097190-79-8
C_ID C00047236 ,
InChIKey PYFLPJICKBMZSN-AVCHOTBHNA-N
InChICode InChI=1S/C38H46O9/c1-19(2)10-9-11-20(3)12-13-23-29(39)28-30(40)25-16-22-17-26-36(7,8)47-37(33(22)41,15-14-21(4)34(42)43)38(25,26)46-32(28)24-18-27(35(5,6)44)45-31(23)24/h10,12,14,16,22,26-27,39,44H,9,11,13,15,17-18H2,1-8H3,(H,42,43)/b20-12+,21-14+/t22-,26+,27-,37+,38-/m1/s1
SMILES C1(=O)[C@@H]2C=C3[C@@]4([C@]1(OC([C@@H]4C2)(C)C)C/C=C(/C(=O)O)\C)Oc1c(C3=O)c(c(c2c1C[C@@H](O2)C(C)(O)C)C/C=C(/CCC=C(C)C)\C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia hanburyi Ref.
zoom in