input word = C00043169

Metabolite InformationStructural formula
Name 2,7-Dideacetyltaxuspine X
(+)-2,7-Dideacetyltaxuspine X
Formula C37H46O12
Mw 682.29892693
CAS RN 259678-75-6
C_ID C00043169 ,
InChIKey FIUCYFQSNWIGHE-IPPYHVDONA-N
InChICode InChI=1S/C37H46O12/c1-20-29(42)18-32(49-33(44)15-14-26-12-10-9-11-13-26)27(19-45-22(3)38)16-30(43)28-17-31(46-23(4)39)21(2)34(37(28,7)8)36(48-25(6)41)35(20)47-24(5)40/h9-16,28-32,36,42-43H,17-19H2,1-8H3/b15-14+,27-16+,35-20-/t28-,29+,30+,31+,32+,36-/m1/s1
SMILES C\1(=C(/[C@@H](C2=C([C@H](C[C@H]([C@H](/C=C(/[C@H](C[C@@H]1O)OC(=O)/C=C/c1ccccc1)\COC(=O)C)O)C2(C)C)OC(=O)C)C)OC(=O)C)\OC(=O)C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus cuspidata Ref.
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