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Methyl (7Z,18E,20Z)-2,10,12,14,16-pentahydroxy-4-methoxy-3,7,9,11,15,17,21-heptamethyl-25-(methylsulfanyl)-6,22,26,28-tetraoxo-23-azatricyclo[22.3.1.05,27]octacosa-1(27),2,4,7,18,20,24-heptaene-13-carboxylate
[CAS# 87913-35-7]

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CAS#: 87913-35-7
Product: Methyl (7Z,18E,20Z)-2,10,12,14,16-pentahydroxy-4-methoxy-3,7,9,11,15,17,21-heptamethyl-25-(methylsulfanyl)-6,22,26,28-tetraoxo-23-azatricyclo[22.3.1.05,27]octacosa-1(27),2,4,7,18,20,24-heptaene-13-carboxylate
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Identification
Name Methyl (7Z,18E,20Z)-2,10,12,14,16-pentahydroxy-4-methoxy-3,7,9,11,15,17,21-heptamethyl-25-(methylsulfanyl)-6,22,26,28-tetraoxo-23-azatricyclo[22.3.1.05,27]octacosa-1(27),2,4,7,18,20,24-heptaene-13-carboxylate
Synonyms Antibiotic Tan 528A; Awamycin; Protostreptovaricin I, 10,25-didemethyl-21-hydroxy-10-(methoxycarbonyl)-19-O-methyl-25-(methylthio)-
Molecular Structure CAS#: 87913-35-7, Methyl (7Z,18E,20Z)-2,10,12,14,16-pentahydroxy-4-methoxy-3,7,9,11,15,17,21-heptamethyl-25-(methylsulfanyl)-6,22,26,28-tetraoxo-23-azatricyclo[22.3.1.0<sup>5,27</sup>]octacosa-1(27),2,4,7,18,20,24-heptaene-13-carboxylate
Molecular Formula C38H49NO12S
Molecular Weight 743.86
CAS Registry Number 87913-35-7
SMILES O=C1c2c3C(=O)/C(=C1/SC)NC(=O)/C(=C\C=C\C(C(O)C(C)C(O)C(C(=O)OC)C(O)C(C)C(O)C(/C=C(\C(=O)c2c(OC)c(c3O)C)C)C)C)C
InChI 1S/C38H49NO12S/c1-15-12-11-13-16(2)37(48)39-26-33(46)23-22(34(47)36(26)52-10)24(35(50-8)21(7)32(23)45)29(42)18(4)14-17(3)28(41)20(6)31(44)25(38(49)51-9)30(43)19(5)27(15)40/h11-15,17,19-20,25,27-28,30-31,40-41,43-45H,1-10H3,(H,39,48)/b12-11+,16-13-,18-14-
InChIKey WZCNXFSCUFEMGW-UMLOSGLNSA-N
Properties
Density 1.351g/cm3 (Cal.)
Boiling point 991.271°C at 760 mmHg (Cal.)
Flash point 553.301°C (Cal.)
Market Analysis Reports
List of Reports Available for Methyl (7Z,18E,20Z)-2,10,12,14,16-pentahydroxy-4-methoxy-3,7,9,11,15,17,21-heptamethyl-25-(methylsulfanyl)-6,22,26,28-tetraoxo-23-azatricyclo[22.3.1.05,27]octacosa-1(27),2,4,7,18,20,24-heptaene-13-carboxylate
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