input word = C00049440

Metabolite InformationStructural formula
Name Decinnamoyltaxinine B 11,12-epoxide
Formula C28H38O11
Mw 550.24141206
CAS RN 182167-00-6
C_ID C00049440 ,
InChIKey OYGYAJRTYGLJDV-XRKOWUJNNA-N
InChICode InChI=1S/C28H38O11/c1-12-18(33)11-20(35-13(2)29)26(8)21(12)22(36-14(3)30)17-10-19(34)27(9)28(39-27,25(17,6)7)24(38-16(5)32)23(26)37-15(4)31/h17-18,20-24,33H,1,10-11H2,2-9H3/t17-,18-,20-,21-,22+,23-,24-,26+,27+,28-/m0/s1
SMILES C1(=O)C[C@@H]2C([C@]3([C@]1(C)O3)[C@H]([C@@H]([C@]1([C@H]([C@@H]2OC(=O)C)C(=C)[C@H](C[C@@H]1OC(=O)C)O)C)OC(=O)C)OC(=O)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus yunnanensis Ref.
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