input word = C00034900

Metabolite InformationStructural formula
Name Swietephragmin D
Formula C36H44O12
Mw 668.28327687
CAS RN 878786-93-7
C_ID C00034900 ,
InChIKey FWKDHGIXHPHDTH-JVHHUWDWNA-N
InChICode InChI=1S/C36H44O12/c1-9-19(4)26(39)45-27-30(6)17-32(40)31(7,21(30)14-23(37)42-8)33-12-11-29(5)22(15-24(38)44-25(29)20-10-13-43-16-20)35(33)28(34(27,32)41)46-36(47-33,48-35)18(2)3/h9-10,13,15-16,18,21,25,27-28,40-41H,11-12,14,17H2,1-8H3/b19-9+/t21-,25-,27-,28+,29+,30+,31+,32+,33-,34-,35+,36-/m0/s1
SMILES [C@]12(C(=CC(=O)O[C@H]1c1cocc1)[C@]13[C@]4(CC2)[C@]2([C@]5([C@@]([C@H]1O[C@@](O4)(O3)C(C)C)([C@H]([C@@]([C@@H]2CC(=O)OC)(C5)C)OC(=O)/C(=C/C)/C)O)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeSwietenia mahogani Ref.
PlantaeMeliaceaeSwietenia mahogany Ref.
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