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(1r,5s,6s,7r,10s,14s,16s)-6,10-Dihydroxy-5,7,9,9-Tetramethyl-14-[(E)-1-(2-Methyl-1,3-Thiazol-4-Yl)Prop-1-En-2-Yl]-13,17-Dioxabicyclo[14.1.0]Heptadecane-8,12-Dione

Error correction

(1R,5S,6S,7R,10S,14S,16S)-6,10-Dihydroxy-5,7,9,9-Tetramethyl-14-[(E)-1-(2-Methyl-1,3-Thiazol-4-Yl)Prop-1-En-2-Yl]-13,17-Dioxabicyclo[14.1.0]Heptadecane-8,12-Dione / CAS : 152044-53-6

Appearance solid UN -
HS 29341090 DG Class -
Synonyms Epothilone A; Epo A; Epithilone A; Epothilones; Epothilon A; (1S,3S,7S,10R,11S,12S,16R)-7,11-Dihydroxy-8,8,10,12-Tetramethyl-3-[(E)-1-(2-Methyl-1,3-Thiazol-4-Yl)Prop-1-En-2-Yl]-4,17-Dioxabicyclo[14.1.0]Heptadecane-5,9-Dione
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Properties

Summary

Formula
C26H39NO6S
Molecular Mass
493.65600
Exact Mass
493.25000
PSA
137.49000
Logp
4.08740
IUPAC
(1S,3S,7S,10R,11S,12S,16R)-7,11-dihydroxy-8,8,10,12-tetramethyl-3-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-4,17-dioxabicyclo[14.1.0]heptadecane-5,9-dione
SMILES
C[C@H]1CCC[C@@H]2[C@@H](O2)C[C@H](OC(=O)C[C@@H](C(C(=O)[C@@H]([C@H]1O)C)(C)C)O)/C(=C/C3=CSC(=N3)C)/C

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Raw Materials
Plant and Other Extracts > Fungus Extract

Chemical and Physical Properties

Melting Point
95ºC
Density
1.143g/cm3
Boiling Point
683.3ºC
Flash Point
367.1ºC
Appearance
solid

Export information

HS Code
29341090
Export Rebate
13%

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