Telavancin hydrochloride structure, CAS 560130-42-9

Telavancin hydrochloride

CAS Number560130-42-9

SynonymsTelavancin hydrochloride

Molecular FormulaC80H107Cl3N11O27P

Molecular Weight1792.096

Purity

Density

Boiling Point

Melting Point

Flash Point

Appearance

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Cat. No.: 2A-3185273 Purity:
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Chemical & Physical Properties
CAS Number560130-42-9
Catalog No.2A-3185273
Chinese Name盐酸特拉万星
SynonymsTelavancin hydrochloride
Molecular FormulaC80H107Cl3N11O27P
Molecular Weight1792.096
Storage Conditionroom temperature
PubChem ID14768788
SMILESCCCCCCCCCCNCCNC1(C)CC(OC2C(Oc3c4cc5cc3Oc3ccc(cc3Cl)C(O)C3NC(=O)C(NC(=O)C5NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C(CC(C)C)NC)C(O)c5ccc(c(Cl)c5)O4)c4ccc(O)c(c4)-c4c(cc(O)c(CNCP(=O)(O)O)c4O)C(C(=O)O)NC3=O)OC(CO)C(O)C2O)OC(C)C1O.Cl
InChIInChI=1S/C80H106Cl2N11O27P.ClH/c1-7-8-9-10-11-12-13-14-21-85-22-23-87-80(5)32-57(115-37(4)71(80)103)119-70-68(102)67(101)55(34-94)118-79(70)120-69-53-28-41-29-54(69)117-52-20-17-40(27-46(52)82)65(99)63-77(109)91-61(78(110)111)43-30-50(96)44(33-86-35-121(112,113)114)66(100)58(43)42-25-38(15-18-49(42)95)59(74(106)93-63)90-75(107)60(41)89-73(105)48(31-56(83)97)88-76(108)62(92-72(104)47(84-6)24-36(2)3)64(98)39-16-19-51(116-53)45(81)26-39;/h15-20,25-30,36-37,47-48,55,57,59-65,67-68,70-71,79,84-87,94-96,98-103H,7-14,21-24,31-35H2,1-6H3,(H2,83,97)(H,88,108)(H,89,105)(H,90,107)(H,91,109)(H,92,104)(H,93,106)(H,110,111)(H2,112,113,114);1H/t37-,47+,48-,55+,57-,59+,60+,61-,62+,63-,64+,65+,67+,68-,70+,71+,79-,80-;/m0./s1
InChI KeyGSSIWSIRBWAZHG-ACOPVEIWSA-N
Transport InfoProduct Name: Telavancin Hydrochloride
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