input word = C00060150

Metabolite InformationStructural formula
Name 2,9,10-Tri-O-acetyltaxicin I
Formula C26H36O9
Mw 492.23593275
CAS RN 158137-46-3
C_ID C00060150
InChIKey HMVNDOFAGCGZSA-OPHIHEFFSA-N
InChICode InChI=1S/C26H36O9/c1-12-17(30)9-10-25(8)20(12)22(34-15(4)28)26(32)11-18(31)13(2)19(24(26,6)7)21(33-14(3)27)23(25)35-16(5)29/h17,20-23,30,32H,1,9-11H2,2-8H3/t17-,20-,21+,22-,23-,25+,26+/m0/s1
SMILES C=C1C(O)CCC2(C)C(OC(C)=O)C(OC(C)=O)C3=C(C)C(=O)CC(O)(C(OC(C)=O)C12)C3(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus baccata Ref.
PlantaeTaxaceaeTaxus cuspidata Ref.
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