input word = C00034899

Metabolite InformationStructural formula
Name Swietephragmin C
Formula C37H46O12
Mw 682.29892693
CAS RN 878786-92-6
C_ID C00034899 ,
InChIKey SPKRHHRYAOXOEE-JCNXTFIUNA-N
InChICode InChI=1S/C37H46O12/c1-9-19(3)27(40)46-28-31(6)18-33(41)32(7,22(31)15-24(38)43-8)34-13-12-30(5)23(16-25(39)45-26(30)21-11-14-44-17-21)36(34)29(35(28,33)42)47-37(48-34,49-36)20(4)10-2/h9,11,14,16-17,20,22,26,28-29,41-42H,10,12-13,15,18H2,1-8H3/b19-9+/t20-,22-,26-,28-,29+,30+,31+,32+,33+,34-,35-,36+,37-/m0/s1
SMILES C/C=C(C)C(=O)O[C@H]1[C@]2(C)C[C@]3(O)[C@@]1(O)[C@H]1OC4(C(C)CC)O[C@@]5(CC[C@]6(C)C(=CC(=O)O[C@H]6c6ccoc6)[C@@]15O4)[C@]3(C)[C@H]2CC(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeSwietenia mahogani Ref.
PlantaeMeliaceaeSwietenia mahogany Ref.
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OrganismSwietenia mahogany
ReferenceAbdelgaleil, et al., Phytochemistry, 67, (2006), 452