input word = C00000901

Metabolite InformationStructural formula
Name Taxuyunnanine C
Taxuyunnanin C
Sinenxan A
Formula C28H40O8
Mw 504.27231825
CAS RN 156127-34-3
C_ID C00000901 ,
InChIKey KFFHSFCOKCGBBW-MDAUCIJJNA-N
InChICode InChI=1S/C28H40O8/c1-14-12-21(34-17(4)30)25-26(36-19(6)32)24-15(2)20(33-16(3)29)10-11-28(24,9)13-22(35-18(5)31)23(14)27(25,7)8/h20-22,24-26H,2,10-13H2,1,3-9H3/t20-,21-,22-,24-,25-,26-,28-/m0/s1
SMILES C1[C@@H]([C@@H]2C(C(=C1C)[C@H](C[C@@]1(CC[C@@H](C(=C)[C@H]1[C@@H]2OC(=O)C)OC(=O)C)C)OC(=O)C)(C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus chinensis Ref.
PlantaeTaxaceaeTaxus cuspidata Ref.
PlantaeTaxaceaeTaxus mairei Ref.
PlantaeTaxaceaeTaxus yunnanensis Ref.
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OrganismTaxus chinensis
ReferenceFleming,J. Am. Chem. Soc,115,(1993),805