input word = C00042981

Metabolite InformationStructural formula
Name Scortechinone T
(-)-Scortechinone T
Formula C35H44O9
Mw 608.298533
CAS RN 863024-45-7
C_ID C00042981 ,
InChIKey UMRUGVMKZFBRLT-RJEVLYOFNA-N
InChICode InChI=1S/C35H44O9/c1-17(2)11-12-20-25(37)22-26(38)23-29(40-9)33(41-10)15-21-32(7,8)44-34(30(33)39,14-13-18(3)16-36)35(21,23)43-28(22)24-27(20)42-19(4)31(24,5)6/h11,13,16,19,21,23,29,37H,12,14-15H2,1-10H3/b18-13+/t19-,21+,23-,29-,33-,34+,35+/m0/s1
SMILES C1(=O)[C@]2([C@H]([C@H]3[C@]4([C@@]1(OC([C@H]4C2)(C)C)C/C=C(/C=O)\C)Oc1c(C3=O)c(c(c2c1C([C@@H](O2)C)(C)C)CC=C(C)C)O)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia scortechinii Ref.
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OrganismGarcinia scortechinii
ReferenceSukpondma,J.Nat.Prod.,68,(2005),1010