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 [C@@H]1([C@@]2([C@@H]([C@H]([C@@]3(C(=C([C@@H](C3)OC(=O)C)C)[C@@H]1OC(=O)C)C(C)(O)C)OC(=O)C)[C@@]1([C@@H](C[C@@H]2OC(=O)C)OC(=O)C)OC1)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus chinensis Ref.
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