input word = C00049499

Metabolite InformationStructural formula
Name O-Cinnamoyltaxicin I
Formula C29H36O7
Mw 496.2461035
CAS RN 11034-45-0
C_ID C00049499 ,
InChIKey LMHMWINKBZRNRU-LUIMYYDANA-N
InChICode InChI=1S/C29H36O7/c1-16-19(30)15-29(35)25(33)23-17(2)20(36-21(31)12-11-18-9-7-6-8-10-18)13-14-28(23,5)26(34)24(32)22(16)27(29,3)4/h6-12,20,23-26,32-35H,2,13-15H2,1,3-5H3/b12-11+/t20-,23-,24+,25-,26-,28+,29+/m0/s1
SMILES C=C1[C@@H](OC(=O)/C=C/c2ccccc2)CC[C@@]2(C)[C@@H](O)[C@H](O)C3=C(C)C(=O)C[C@@](O)([C@@H](O)[C@H]12)C3(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus baccata Ref.
PlantaeTaxaceaeTaxus cuspidata Ref.
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