Structure

Taxinine M

CAS
135730-55-1
Catalog Number
ACM135730551
Category
Other Products
Molecular Weight
686.70
Molecular Formula
C35H42O14

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Specification

IUPAC Name
(2β,5α,7β,9α,10β)-2,7,9,10-Tetraacetoxy-5,11-dihydroxy-14-oxo-12,...
Canonical SMILES
CC(=O)OC1CC(C(=C)C2C1(C(C(C3(C4(CC(=O)C(C2OC(=O)C)C3(CO4)C)C)O)OC(=O)C)OC(=O)C)COC(=O)C5=CC=CC=C5)O
InChI
InChI=1S/C35H42O14/c1-17-23(40)13-25(46-18(2)36)34(16-44-31(42)22-11-9-8-10-12-22)26(17)28(47-19(3)37)27-24(41)14-33(7)35(43,32(27,6)15-45-33)30(49-21(5)39)29(34)48-20(4)38/h8-12,23,25-30,40,43H,1,13-16H2,2-7H3/t23-,25-,26-,27-,28+,29-,30-,32-,33-,34+,35-/m0/s1
InChI Key
NLPSSNXRGVDJMP-NTOIUUNRSA-N
Boiling Point
738.7ºC at 760mmHg
Flash Point
224.9ºC
Density
1.37g/cm³
Appearance
Powder
Exact Mass
686.25700
Alfa Chemistry

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