input word = C00048169

Metabolite InformationStructural formula
Name Swietenitin G
(-)-Swietenitin G
Formula C41H52O18
Mw 832.31536486
CAS RN 1173892-09-5
C_ID C00048169 ,
InChIKey UOXYGCFXPXLKRL-UHFFFAOYNA-N
InChICode InChI=1S/C41H52O18/c1-19-35(7,55-19)32(48)54-30-34(6)18-38-36(8,24(34)14-27(46)49-10)41-26(45)16-33(5,29(52-20(2)42)23-12-13-51-17-23)25(15-28(47)50-11)39(41,58-37(9,57-38)59-41)31(53-21(3)43)40(30,38)56-22(4)44/h12-13,17,19,24-26,29-31,45H,14-16,18H2,1-11H3/t19-,24+,25+,26-,29-,30+,31+,33-,34-,35-,36-,37-,38-,39-,40+,41+/m0/s1
SMILES COC(=O)CC1C(C)(C(OC(C)=O)c2ccoc2)CC(O)C23OC4(C)OC12C(OC(C)=O)C1(OC(C)=O)C(OC(=O)C2(C)OC2C)C2(C)CC1(O4)C3(C)C2CC(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeSwietenia macrophylla Ref.
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