Chem
J-GLOBAL ID：200907024130421594   Nikkaji number：J2.760.267C

N-Acetyl-D-glucosaminyl-N-acetylmuramoyl-L-alanyl-D-γ-glutamyl-6-carboxy-L-lysyl-D-alanine

N-アセチル-D-グルコサミニル-N-アセチルムラモイル-L-アラニル-D-γ-グルタミル-6-カルボキシ-L-リシル-D-アラニン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C37H61N7O21
Molecular formula furigana： C37-H61-N7-O21
Molecular weight： 939.923
InChI： InChI=1S/C37H61N7O21/c1-13(30(52)44-20(35(59)60)9-10-23(49)43-19(8-6-7-18(38)34(57)58)32(54)40-14(2)33(55)56)39-31(53)15(3)62-29-25(42-17(5)48)36(61)63-22(12-46)28(29)65-37-24(41-16(4)47)27(51)26(50)21(11-45)64-37/h13-15,18-22,24-29,36-37,45-46,50-51,61H,6-12,38H2,1-5H3,(H,39,53)(H,40,54)(H,41,47)(H,42,48)(H,43,49)(H,44,52)(H,55,56)(H,57,58)(H,59,60)/t13-,14+,15+,18?,19-,20+,21+,22+,24+,25+,26+,27+,28+,29+,36-,37-/m0/s1
InChI key： BLHSZJFFDPSTHR-DKORNWFHSA-N
SMILES： C[C@@H](NC(=O)[C@H](CCCC(N)C(=O)O)NC(=O)CC[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](C)O[C@@H]1[C@@H](NC(=O)C)[C@@H](O)O[C@H](CO)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(=O)C)C(=O)O)C(=O)O
Systematic name  (3)：
  • N-[4-O-[2-(アセチルアミノ)-2-デオキシ-β-D-グルコピラノシル]-N-アセチル-α-ムラモイル]-L-Ala-D-γGlu-6-カルボキシ-L-Lys-D-Ala-OH
  • (6S)-2-アミノ-6-[(4R)-4-カルボキシ-4-[(2S)-2-[(2R)-2-{[(2S,3R,4R,5S,6R)-3-アセトアミド-5-{[(2S,3R,4R,5S,6R)-3-アセトアミド-4,5-ジヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-2-ヒドロキシ-6-(ヒドロキシメチル)オキサン-4-イル]オキシ}プロパンアミド]プロパンアミド]ブタンアミド]-6-{[(1R)-1-カルボキシエチル]カルバモイル}ヘキサン酸
  • (6S)-2-amino-6-[(4R)-4-carboxy-4-[(2S)-2-[(2R)-2-{[(2S,3R,4R,5S,6R)-3-acetamido-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}propanamido]propanamido]butanamido]-6-{[(1R)-1-carboxyethyl]carbamoyl}hexanoic acid
Other name (3)：
  • N-[4-O-[2-(Acetylamino)-2-deoxy-β-D-glucopyranosyl]-N-acetyl-α-muramoyl]-L-Ala-D-γGlu-6-carboxy-L-Lys-D-Ala-OH
  • N-Acetyl-D-glucosaminyl-N-acetylmuramoyl-L-alanyl-D-γ-glutamyl-6-carboxy-L-lysyl-D-alanine
  • N-アセチル-D-グルコサミニル-N-アセチルムラモイル-L-アラニル-D-γ-グルタミル-6-カルボキシ-L-リシル-D-アラニン
KEGG COMPOUND： C04904
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM