input word = C00041154

Metabolite InformationStructural formula
Name Taxchinin C
Formula C47H50O14
Mw 838.32005631
CAS RN 152110-14-0
C_ID C00041154 ,
InChIKey SKICGKCRGMFJSZ-OMCCJTBMNA-N
InChICode InChI=1S/C47H50O14/c1-26-33(56-27(2)48)24-46(44(5,6)54)36(26)37(58-41(51)30-17-11-8-12-18-30)39(59-42(52)31-19-13-9-14-20-31)45(7)34(57-28(3)49)23-35-47(25-55-35,61-29(4)50)38(45)40(46)60-43(53)32-21-15-10-16-22-32/h8-22,33-35,37-40,54H,23-25H2,1-7H3/t33-,34-,35+,37+,38-,39-,40-,45+,46-,47-/m0/s1
SMILES C1[C@@H]2[C@]([C@@H]3[C@@]([C@H]1OC(=O)C)([C@H]([C@@H](C1=C([C@H](C[C@]1([C@H]3OC(=O)c1ccccc1)C(C)(C)O)OC(=O)C)C)OC(=O)c1ccccc1)OC(=O)c1ccccc1)C)(CO2)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus chinensis Ref.
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