input word = C00048299

Metabolite InformationStructural formula
Name 7-epi-Isogarcinol
7-epiisogarcinol
Formula C38H50O6
Mw 602.36073933
CAS RN 1141378-40-6
C_ID C00048299 ,
InChIKey KXTNVBQRLRYVCO-ZJBPRGPWNA-N
InChICode InChI=1S/C38H50O6/c1-22(2)11-14-26-20-37-21-27(15-12-23(3)4)36(9,10)44-33(37)30(31(41)25-13-16-28(39)29(40)19-25)32(42)38(34(37)43,35(26,7)8)18-17-24(5)6/h11-13,16-17,19,26-27,39-40H,14-15,18,20-21H2,1-10H3/t26-,27-,37-,38-/m0/s1
SMILES [C@@H]1(C[C@@]23C(=C(C(=O)[C@@](C1(C)C)(CC=C(C)C)C3=O)C(=O)c1ccc(c(c1)O)O)OC([C@H](C2)CC=C(C)C)(C)C)CC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae-GuttiferaeMoronobea coccinea Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia epunctata Ref.
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OrganismMoronobea coccinea
ReferenceMarti,Phytochem.,70,(2009),75