input word = C00041171

Metabolite InformationStructural formula
Name Taxuchin A
Formula C32H44O14
Mw 652.27310612
CAS RN 158243-08-4
C_ID C00041171 ,
InChIKey LFORUQDCIMULOP-UHFFFAOYNA-N
InChICode InChI=1S/C32H44O14/c1-14-21(41-15(2)33)12-31(29(8,9)39)24(14)25(44-18(5)36)27(45-19(6)37)30(10)22(42-16(3)34)11-23(43-17(4)35)32(13-40-32)26(30)28(31)46-20(7)38/h21-23,25-28,39H,11-13H2,1-10H3/t21-,22+,23-,25+,26-,27-,28-,30+,31-,32-/m1/s1
SMILES CC(=O)OC1CC2(C(C)(C)O)C(=C1C)C(OC(C)=O)C(OC(C)=O)C1(C)C(OC(C)=O)CC(OC(C)=O)C3(CO3)C1C2OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus chinensis Ref.
PlantaeTaxaceaeTaxus yunnanensis Ref.
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OrganismTaxus chinensis
ReferenceParmar,Phytochem.,50,(1999),1267