input word = C00038154

Metabolite InformationStructural formula
Name 12-O-Methylvolkensin
(-)-12-O-Methylvolkensin
Formula C34H46O9
Mw 598.31418307
CAS RN 244179-69-9
C_ID C00038154 ,
InChIKey XDLKVPLICUIRQM-CDFQVKRJNA-N
InChICode InChI=1S/C34H46O9/c1-9-17(2)31(37)43-25-14-24(41-19(4)35)32(5)16-40-28-29(32)33(25,6)23-13-26(38-8)42-22-12-21(20-10-11-39-15-20)18(3)27(22)34(23,7)30(28)36/h9-11,15,21-26,28-30,36H,12-14,16H2,1-8H3/b17-9+/t21-,22+,23-,24-,25+,26-,28-,29+,30-,32-,33+,34-/m1/s1
SMILES [C@]12([C@H](C[C@@H](O[C@@H]3C1=C([C@@H](C3)c1cocc1)C)OC)[C@@]1([C@H]3[C@H]([C@H]2O)OC[C@@]3([C@@H](C[C@@H]1OC(=O)/C(=C/C)/C)OC(=O)C)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeMelia toosendan Sieb.et Zuce. Ref.
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