input word = C00049410

Metabolite InformationStructural formula
Name 10-Deacetyltaxinine B
(+)-10-Deacetyltaxinine B
Formula C35H42O10
Mw 622.27779756
CAS RN 155601-64-2
C_ID C00049410 ,
InChIKey TUEORTUUXYOYDZ-KFPLBJHLNA-N
InChICode InChI=1S/C35H42O10/c1-18-25(39)16-24-32(43-21(4)37)30-19(2)26(45-28(40)15-14-23-12-10-9-11-13-23)17-27(42-20(3)36)35(30,8)33(44-22(5)38)31(41)29(18)34(24,6)7/h9-15,24,26-27,30-33,41H,2,16-17H2,1,3-8H3/b15-14+/t24-,26-,27-,30-,31+,32+,33-,35+/m0/s1
SMILES C1(=O)C[C@@H]2C(C(=C1C)[C@H]([C@@H]([C@]1([C@H]([C@@H]2OC(=O)C)C(=C)[C@H](C[C@@H]1OC(=O)C)OC(=O)/C=C/c1ccccc1)C)OC(=O)C)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus cuspidata Ref.
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OrganismTaxus cuspidata
ReferenceBaloglu,J.Nat.Prod.,62,(1999),1448