input word = C00042528

Metabolite InformationStructural formula
Name Garcihombronane B
Formula C31H50O5
Mw 502.36582471
CAS RN 313947-63-6
C_ID C00042528 ,
InChIKey CIVHEWNEBOOQEN-GBFQUUEJNA-N
InChICode InChI=1S/C31H50O5/c1-19(26(34)36-8)17-21(32)18-20(2)28(5)13-11-22-23-9-10-24-27(3,4)25(33)12-14-30(24,7)31(23,35)16-15-29(22,28)6/h11,17,20-21,23-25,32-33,35H,9-10,12-16,18H2,1-8H3/b19-17+/t20-,21+,23+,24+,25-,28+,29-,30+,31-/m1/s1
SMILES COC(=O)/C(C)=C/[C@H](O)C[C@@H](C)[C@]1(C)CC=C2[C@@H]3CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)[C@@]3(O)CC[C@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia hombroniana Ref.
zoom in