input word = C00053206

Metabolite InformationStructural formula
Name Garcihombronane I
Formula C30H48O4
Mw 472.35526002
CAS RN 863889-37-6
C_ID C00053206
InChIKey GBEVCPIJOYQRAL-HEGPDJCKSA-N
InChICode InChI=1S/C30H48O4/c1-19(25(32)33)9-8-10-20(2)27(5)17-18-28(6)22(27)13-16-30(34)23(28)12-11-21-26(3,4)24(31)14-15-29(21,30)7/h9,13,20-21,23-24,31,34H,8,10-12,14-18H2,1-7H3,(H,32,33)/b19-9+/t20-,21+,23+,24+,27+,28-,29+,30-/m1/s1
SMILES C[C@@]1([C@H](C)CC/C=C(C)/C(O)=O)CC[C@@]2(C)[C@]3([H])CC[C@@]4([H])C(C)(C)[C@@H](O)CC[C@]4(C)[C@@]3(O)CC=C21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia hombroniana Ref.
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