input word = C00024107

Metabolite InformationStructural formula
Name Swietenin E
Formula C32H42O9
Mw 570.28288294
CAS RN 4802-01-0
C_ID C00024107 ,
InChIKey AKVIKOHFNOZMCC-ZCSSRNPMNA-N
InChICode InChI=1S/C32H42O9/c1-8-16(2)28(36)41-27-19-13-18-20(32(6,25(19)35)24(30(27,3)4)23(34)29(37)38-7)9-11-31(5)21(18)14-22(33)40-26(31)17-10-12-39-15-17/h10,12-13,15-16,19-21,23-24,26-27,34H,8-9,11,14H2,1-7H3/t16-,19-,20+,21+,23-,24+,26+,27-,31-,32-/m1/s1
SMILES CCC(C)C(=O)O[C@@H]1[C@@H]2C=C3[C@@H]4CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CC[C@@H]3[C@@](C)(C2=O)[C@@H]([C@@H](O)C(=O)OC)C1(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeSwietenia mahagoni JACQ. Ref.
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