input word = C00041180

Metabolite InformationStructural formula
Name Taxusabietane D
(+)-Taxusabietane D
Formula C38H50O16
Mw 762.30988555
CAS RN 220785-05-7
C_ID C00041180 ,
InChIKey CXTTYCULUTUTIW-FSMZXNFLNA-N
InChICode InChI=1S/C38H50O16/c1-17(2)24-13-25-26(49-20(5)41)14-28-37(9,10)29(45)11-12-38(28,16-48-19(4)40)30(25)31(46)32(24)54-36-35(52-23(8)44)34(51-22(7)43)33(50-21(6)42)27(53-36)15-47-18(3)39/h13,17,26-28,33-36,46H,11-12,14-16H2,1-10H3/t26-,27+,28-,33+,34-,35+,36-,38+/m0/s1
SMILES c1(c2c(cc(c1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)OC(=O)C)COC(=O)C)C(C)C)[C@H](C[C@@H]1[C@@]2(CCC(=O)C1(C)C)COC(=O)C)OC(=O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus mairei Ref.
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