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Echinocandin B

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Echinocandin B / CAS : 54651-05-7

Appearance solid UN -
HS 29419090 DG Class -
Synonyms Echinocandin B Impurity; Unii-Cnw0Zw8Ztq; Cnw0Zw8Ztq; Antibiotic Sl 7810F
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Properties

Summary

Formula
C52H81N7O16
Molecular Mass
1060.24000
Exact Mass
1059.57000
PSA
368.19000
Logp
0.25150
IUPAC
(9Z,12Z)-N-[(3S,6S,9S,11R,15S,18S,20R,21R,24S,25S,26S)-6-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-11,20,21,25-tetrahydroxy-3,15-bis[(1R)-1-hydroxyethyl]-26-methyl-2,5,8,14,17,23-hexaoxo-1,4,7,13,16,22-hexazatricyclo[22.3.0.09,13]heptacosan-18-yl]octadeca-9,12-dienamide
SMILES
CCCCC/C=C\C/C=C\CCCCCCCC(=O)N[C@H]1C[C@H]([C@H](NC(=O)[C@@H]2[C@H]([C@H](CN2C(=O)[C@@H](NC(=O)C(NC(=O)[C@@H]3C[C@H](CN3C(=O)C(NC1=O)[C@@H](C)O)O)[C@@H]([C@H](C4=CC=C(C=C4)O)O)O)[C@@H](C)O)C)O)O)O

Attribute classification

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

Chemical and Physical Properties

Appearance
solid
Acidity and Basicity
neutral

Export information

HS Code
29419090
Export Rebate
13%

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