input word = C00042544

Metabolite InformationStructural formula
Name Garsubellin E
(-)-Garsubellin E
Formula C31H46O5
Mw 498.33452458
CAS RN 194410-35-0
C_ID C00042544 ,
InChIKey JLTYOSMJDLPOFE-UDVSVEALNA-N
InChICode InChI=1S/C31H46O5/c1-11-20(6)24(32)31-25(33)22-16-23(29(9,10)35)36-26(22)30(27(31)34,15-14-19(4)5)17-21(28(31,7)8)13-12-18(2)3/h12,14,20-21,23,35H,11,13,15-17H2,1-10H3/t20-,21+,23+,30-,31+/m0/s1
SMILES C1([C@@H](C[C@]2(C3=C(C(=O)[C@]1(C(=O)[C@H](CC)C)C2=O)C[C@@H](O3)C(C)(C)O)CC=C(C)C)CC=C(C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia subelliptica Ref.
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