input word = C00043968

Metabolite InformationStructural formula
Name Taxezopidine L
Formula C39H46O15
Mw 754.2836708
CAS RN 219749-76-5
C_ID C00043968 ,
InChIKey YJLKXWCZWJGUAN-SAWFDMKQNA-N
InChICode InChI=1S/C39H46O15/c1-20-28(54-31(46)15-14-26-12-10-9-11-13-26)17-30(50-22(3)41)38(19-48-21(2)40)32(20)33(51-23(4)42)27-16-29(45)37(8)39(47,36(27,7)18-49-37)35(53-25(6)44)34(38)52-24(5)43/h9-15,27-28,30,32-35,47H,1,16-19H2,2-8H3/b15-14+/t27-,28-,30-,32-,33+,34-,35-,36-,37+,38+,39-/m0/s1
SMILES [C@]12(C(=O)C[C@@H]3[C@]([C@]1([C@H]([C@@H]([C@]1([C@@H](C(=C)[C@H](C[C@@H]1OC(=O)C)OC(=O)/C=C/c1ccccc1)[C@@H]3OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)O)(C)CO2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus chinensis Ref.
PlantaeTaxaceaeTaxus cuspidata Ref.
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