CAS 171500-79-1

5,31-Dichloro-38-de(methoxycarbonyl)-7-demethyl-19- deoxy-56-O-[2-deoxy-2-(10-methylundecanamido)-β-Dglucopyranurosyl]- 38-[N-[3-(dimethylamino)- propyl]carbamoyl]-42-O-a-D-mannopyranosyl-N 15- methylristomycin A aglycone

Description:

5,31-Dichloro-38-de(methoxycarbonyl)-7-demethyl-19-deoxy-56-O-[2-deoxy-2-(10-methylundecanamido)-β-D-glucopyranurosyl]-38-[N-[3-(dimethylamino)-propyl]carbamoyl]-42-O-α-D-mannopyranosyl-N15-methylristomycin A aglycone, with CAS number 171500-79-1, is a complex organic compound characterized by its intricate structure, which includes multiple functional groups and substituents. This substance features dichloro and carbamoyl groups, indicating potential reactivity and biological activity. The presence of sugar moieties suggests that it may have glycosidic properties, which could influence its solubility and interaction with biological systems. The compound is likely to exhibit antimicrobial properties, as it is related to ristomycin, a known antibiotic. Its structural complexity may also contribute to its pharmacological profile, including potential effects on cell membranes or enzyme activity. Overall, this compound represents a significant area of interest in medicinal chemistry, particularly in the development of new therapeutic agents.

Formula: Unspecified

InChI: InChI=1S/C88H100Cl2N10O28/c1-38(2)13-10-8-6-7-9-11-14-61(106)94-70-73(109)75(111)78(86(120)121)128-87(70)127-77-58-31-43-32-59(77)124-55-24-19-42(29-50(55)89)71(107)69-85(119)98-67(80(114)92-25-12-26-100(4)5)48-33-44(102)34-57(125-88-76(112)74(110)72(108)60(37-101)126-88)62(48)47-28-40(17-22-52(47)103)65(82(116)99-69)95-83(117)66(43)96-84(118)68-49-35-46(36-54(105)63(49)90)123-56-30-41(18-23-53(56)104)64(91-3)81(115)93-51(79(113)97-68)27-39-15-20-45(122-58)21-16-39/h15-24,28-36,38,51,60,64-76,78,87-88,91,101-105,107-112H,6-14,25-27,37H2,1-5H3,(H,92,114)(H,93,115)(H,94,106)(H,95,117)(H,96,118)(H,97,113)(H,98,119)(H,99,116)(H,120,121)/t51-,60-,64-,65-,66-,67+,68+,69+,70-,71-,72-,73-,74+,75+,76+,78+,87-,88+/m1/s1

InChI key: InChIKey=KGPGQDLTDHGEGT-SZUNQUCBSA-N

SMILES: O(C1=C2C([C@@H](C(NCCCN(C)C)=O)NC(=O)[C@@]3([C@H](O)C=4C=C(Cl)C(=CC4)OC=5C=C6[C@](C(=O)N[C@](C=7C=C2C(O)=CC7)(C(=O)N3)[H])(NC(=O)[C@@]8(C=9C=C(OC=%10C=C([C@@H](NC)C(=O)N[C@@](C(=O)N8)(CC=%11C=CC(OC(=C6)C5O[C@H]%12[C@H](NC(CCCCCCCCC(C)C)=O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)O%12)=CC%11)[H])C=CC%10O)C=C(O)C9Cl)[H])[H])[H])=CC(O)=C1)[C@H]%13O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]%13O

Synonyms:

• 5,31-Dichloro-38-de(methoxycarbonyl)-7-demethyl-19-deoxy-56-O-[2-deoxy-2-[(10-methyl-1-oxoundecyl)amino]-β-<span class="text-smallcaps">D</smallcap>-glucopyranuronosyl]-38-[[[3-(dimethylamino)propyl]amino]carbonyl]-42-O-α-<smallcap>D</span>-mannopyranosyl-N¹⁵-methylristomycin A aglycone
• A-A 1
• B 7011
• Bi-397
• Dalbavancin
• Dalbavancin B₀
• Dalvance
• Mdl 63397
• Ristomycin A aglycone, 5,31-dichloro-38-de(methoxycarbonyl)-7-demethyl-19-deoxy-56-O-[2-deoxy-2-[(10-methyl-1-oxoundecyl)amino]-β-<span class="text-smallcaps">D</smallcap>-glucopyranuronosyl]-38-[[[3-(dimethylamino)propyl]amino]carbonyl]-42-O-α-<smallcap>D</span>-mannopyranosyl-N¹⁵-methyl-
• V-Glycopeptide
• Ver 001
• 5,31-Dichloro-38-de(methoxycarbonyl)-7-demethyl-19-deoxy-56-O-[2-deoxy-2-[(10-methyl-1-oxoundecyl)amino]-β-D-glucopyranuronosyl]-38-[[[3-(dimethylamino)propyl]amino]carbonyl]-42-O-α-D-mannopyranosyl-N15-methylristomycin A aglycone
• Dalbavancin(BI 397, MDL 63397)

Ristomycin A aglycone,5,31-dichloro-38-de(methoxycarbonyl)-7-demethyl-19-deoxy-56-O-[2-deoxy-2-[(10-methyl-1-oxoundecyl)amino]-b-D-glucopyranuronosyl]-38-[[[3-(dimethylamino)propyl]amino]carbonyl]-42-O-a-D-mannopyranosyl-N15-methyl-

CAS: 171500-79-1

Formula: C₈₈H₁₀₀Cl₂N₁₀O₂₈

Purity: 98%

Color and Shape: Solid

Molecular weight: 1816.6918

Ref: IN-DA00ABNL

Dalbavancin

CAS: 171500-79-1

Formula: C₈₈H₁₀₀Cl₂N₁₀O₂₈

Molecular weight: 1816.71

Ref: 4Z-D-176013

Dalbavancin

CAS: 171500-79-1

Dalbavancin (BI-397) is a lipoglycopeptide antibiotic effective against Gram-positive pathogens, MRSA, MRSE, with MIC90s of 0.06-0.25 μg/mL.

Formula: C₈₈H₁₀₀Cl₂N₁₀O₂₈

Purity: 99.09%

Color and Shape: Solid

Molecular weight: 1816.71

Ref: TM-T21358

Dalbavancin Hydrochloride

Controlled Product

CAS: 171500-79-1

Applications Dalbavancin is a second-generation lipoglycopeptide antibiotic. It is a semisynthetic lipoglycopeptide that was designed to improve upon the natural glycopeptides currently available, vancomycin and teicoplanin.
References Scheinfeld, N.: Derm. Online J., 12 (2006); Chen, A., et al.: Int. J. Clin. Prac., 61, 853 (2007)

Formula: C₈₈H₁₀₀Cl₂N₁₀O₂₈·HCl

Color and Shape: Neat

Molecular weight: 1816.69

Ref: TR-D110000

Dalbavancin

CAS: 171500-79-1

Dalbavancin is a lipoglycopeptide antibiotic with action against gram-positive bacteria, including MRSA and is used for treating acute bacterial skin and skin structure infections.

Formula: C₈₈H₁₀₀Cl₂N₁₀O₂₈

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 1,816.69 g/mol

Ref: 3D-AD30090

Dalbavancin

CAS: 171500-79-1

Formula: C₈₈H₁₀₀Cl₂N₁₀O₂₈

Molecular weight: 1816.7

Ref: ST-EA-CP-D132000