input word = C00036108

Metabolite InformationStructural formula
Name 2-Deacetyl-5-decinnamoyltaxinine J
(+)-2-Deacetyl-5-decinnamoyltaxinine J
2-Deacetoxydecinnamoyltaxinine J
(+)-2-Deacetoxydecinnamoyltaxinine J
Formula C28H40O9
Mw 520.26723288
CAS RN 87193-98-4
C_ID C00036108 ,
InChIKey WOKHREABHMWBBE-UZVORMLANA-N
InChICode InChI=1S/C28H40O9/c1-13-20-10-19-11-22(34-15(3)29)14(2)24(27(19,7)8)25(36-17(5)31)26(37-18(6)32)28(20,9)23(12-21(13)33)35-16(4)30/h19-23,25-26,33H,1,10-12H2,2-9H3/t19-,20-,21+,22+,23+,25-,26+,28+/m1/s1
SMILES [C@@H]1(C[C@@H]2C(C(=C1C)[C@H]([C@@H]([C@]1([C@H](C2)C(=C)[C@H](C[C@@H]1OC(=O)C)O)C)OC(=O)C)OC(=O)C)(C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus baccata Ref.
PlantaeTaxaceaeTaxus canadensis Ref.
PlantaeTaxaceaeTaxus chinensis Ref.
PlantaeTaxaceaeTaxus media Ref.
PlantaeTaxaceaeTaxus wallichiana Ref.
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OrganismTaxus wallichiana
ReferenceParmar,Phytochem.,50,(1999),1267