input word = C00034901

Metabolite InformationStructural formula
Name Swietephragmin E
Formula C37H46O13
Mw 698.29384156
CAS RN 878786-94-8
C_ID C00034901 ,
InChIKey JTGDLRQPWQUGEM-SNVBCNRINA-N
InChICode InChI=1S/C37H46O13/c1-9-18(3)26(40)47-28-31(6)17-33(42)32(7,24(31)23(39)27(41)44-8)34-13-12-30(5)21(15-22(38)46-25(30)20-11-14-45-16-20)36(34)29(35(28,33)43)48-37(49-34,50-36)19(4)10-2/h9,11,14-16,19,23-25,28-29,39,42-43H,10,12-13,17H2,1-8H3/b18-9+/t19-,23+,24-,25-,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]2[C@@H](O)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeSwietenia mahogani Ref.
PlantaeMeliaceaeSwietenia mahogany Ref.
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