input word = C00055948

Metabolite InformationStructural formula
Name Isogaudichaudiic acid B
Formula C33H38O9
Mw 578.25158281
CAS RN 1240792-60-2
C_ID C00055948
InChIKey STWVPDVOUVNXOY-JIUGVJLYSA-N
InChICode InChI=1S/C33H38O9/c1-15(2)8-9-19-25(35)20(14-22(34)16(3)4)28-24(26(19)36)27(37)21-12-18-13-23-31(6,7)42-32(29(18)38,33(21,23)41-28)11-10-17(5)30(39)40/h8,10,12,18,22-23,34-36H,3,9,11,13-14H2,1-2,4-7H3,(H,39,40)/b17-10+/t18-,22?,23+,32+,33-/m1/s1
SMILES C=C(C)C(O)Cc1c(O)c(CC=C(C)C)c(O)c2c1O[C@]13C(=C[C@@H]4C[C@H]1C(C)(C)O[C@@]3(C/C=C(C)C(=O)O)C4=O)C2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia lateriflora Ref.
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OrganismGarcinia lateriflora
ReferenceAravind, A. P. A et al., Diversity of Garcinia species in the Western Ghats: Phytochemical Perspective, Chapter 2, (2016), p.19-70.