input word = C00049530

Metabolite InformationStructural formula
Name Taxayuntin B
Formula C31H40O11
Mw 588.25706212
CAS RN 154992-15-1
C_ID C00049530 ,
InChIKey OGAJKHIMOFQOPT-MOJRTSEJNA-N
InChICode InChI=1S/C31H40O11/c1-15-19(34)13-30(28(4,5)38)22(15)23(35)25(36)29(6)20(41-27(37)18-10-8-7-9-11-18)12-21-31(14-39-21,42-17(3)33)24(29)26(30)40-16(2)32/h7-11,19-21,23-26,34-36,38H,12-14H2,1-6H3/t19-,20-,21+,23+,24-,25-,26-,29+,30-,31-/m0/s1
SMILES CC(=O)O[C@H]1[C@@H]2[C@]3(OC(C)=O)CO[C@@H]3C[C@H](OC(=O)c3ccccc3)[C@@]2(C)[C@@H](O)[C@H](O)C2=C(C)[C@@H](O)C[C@]21C(C)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus yunnanensis Ref.
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