Chemical Compound

2-[(4-amino-5-hydroxy-4,6-dimethyltetrahydro-2h-pyran-2-yl)oxy]-22-(2-amino-2-oxoethyl)-15-chloro-48-({4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyltetrahydro-2h-pyran-2-yl)oxy]tetrahydro-2h-pyran-2-yl}oxy)-18,32,35,37-tetrahydroxy-19-{[4-methyl-2-(methylamino)pentanoyl]amino}-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29(45),30,32,34,36,38,46,49-pentadecaene-40-carboxylic acid(non-preferred name)

CAS Registry Number 126985-51-1
2-[(4-amino-5-hydroxy-4,6-dimethyltetrahydro-2h-pyran-2-yl)oxy]-22-(2-amino-2-oxoethyl)-15-chloro-48-({4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyltetrahydro-2h-pyran-2-yl)oxy]tetrahydro-2h-pyran-2-yl}oxy)-18,32,35,37-tetrahydroxy-19-{[4-methyl-2-(methylamino)pentanoyl]amino}-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29(45),30,32,34,36,38,46,49-pentadecaene-40-carboxylic acid(non-preferred name) 结构式
Primary record

2-[(4-amino-5-hydroxy-4,6-dimethyltetrahydro-2h-pyran-2-yl)oxy]-22-(2-amino-2-oxoethyl)-15-chloro-48-({4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyltetrahydro-2h-pyran-2-yl)oxy]tetrahydro-2h-pyran-2-yl}oxy)-18,32,35,37-tetrahydroxy-19-{[4-methyl-2-(methylamino)pentanoyl]amino}-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29(45),30,32,34,36,38,46,49-pentadecaene-40-carboxylic acid(non-preferred name)

库存
2,299 克
纯度
98.4 %
CAS
126985-51-1

化合物标识与属性

CAS
126985-51-1
PubChem CID
195570
SMILES
CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=C4C=C5C=C3OC6=C(C=C(C=C6)C(C(C(=O)NC(C(=O)NC5C(=O)NC7C8=CC(=C(C=C8)O)C9=C(C=C(C=C9O)O)C(NC(=O)C(C(C1=CC=C(O4)C=C1)OC1CC(C(C(O1)C)O)(C)N)NC7=O)C(=O)O)CC(=O)N)NC(=O)C(CC(C)C)NC)O)Cl)CO)O)O)O)O)O
Canonical SMILES
CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(OC3CC(C)(N)C(O)C(C)O3)c3ccc(cc3)Oc3cc2cc(c3OC2OC(CO)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)Oc2ccc(cc2Cl)C1O

名称与同义词

  • Decaplanin
  • AC1Q5UZS
  • RefChem:926003
  • MM 47761
  • MM-47761
  • AC1L508A
  • SCHEMBL29505133
  • GTPL10968
  • DTXSID201365449
  • AR-1D5807
  • BBF-03667
  • C72-H86-Cl-N9-O28
  • CID195570
  • 126985-51-1
  • M86-1410
  • 128441-18-9
  • M 861410
  • 2-(4-amino-5-hydroxy-4,6-dimethyloxan-2-yl)oxy-22-(2-amino-2-oxoethyl)-15-chloro-48-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-18,32,35,37-tetrahydroxy-19-[[4-methyl-2-(methylamino)pentanoyl]amino]-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3(50),4,6(49),8(48),9,11,14,16,29(45),30,32,34(39),35,37,46-pentadecaene-40-carboxylic acid
  • Vancomycin, 22-O-(3-amino-2,3,6-trideoxy-3-C-methyl-alpha-D-arabino-hexopyranosyl)-2'-O-de(3-amino-2,3,6-trideoxy-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-19-dechloro-2'-O-(6-deoxy-alpha-D-talopyranosyl)-
  • 2-[(4-amino-5-hydroxy-4,6-dimethyltetrahydro-2h-pyran-2-yl)oxy]-22-(2-amino-2-oxoethyl)-15-chloro-48-({4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyltetrahydro-2h-pyran-2-yl)oxy]tetrahydro-2h-pyran-2-yl}oxy)-18,32,35,37-tetrahydroxy-19-{[4-methyl-2-(methylamino)pentanoyl]amino}-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29(45),30,32,34,36,38,46,49-pentadecaene-40-carboxylic acid(non-preferred name)
  • 150133-00-9
  • 2-(4-amino-5-hydroxy-4,6-dimethyloxan-2-yl)oxy-22-(2-amino-2-oxoethyl)-15-chloro-48-(4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl)oxy-18,32,35,37-tetrahydroxy-19-((4-methyl-2-(methylamino)pentanoyl)amino)-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentazaoctacyclo(26.14.2.23,6.214,17.18,12.129,33.010,25.034,39)pentaconta-3(50),4,6(49),8(48),9,11,14,16,29(45),30,32,34(39),35,37,46-pentadecaene-40-carboxylic acid