Chem
J-GLOBAL ID:200907016649762728   Nikkaji number:J1.154.981K

Ac-Arg-Gly-Asp-Cha-Gly-NH-GlcNAc

Ac-L-Arg-Gly-L-Asp-3-シクロヘキシル-L-Ala-Gly-[2-(アセチルアミノ)-2-デオキシ-β-D-グルコピラノシル]NH2
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: C33H56N10O13
Molecular formula furigana: C33-H56-N10-O13
Molecular weight: 800.868
InChI: InChI=1S/C33H56N10O13/c1-16(45)39-19(9-6-10-36-33(34)35)29(53)37-13-23(47)41-21(12-25(49)50)31(55)42-20(11-18-7-4-3-5-8-18)30(54)38-14-24(48)43-32-26(40-17(2)46)28(52)27(51)22(15-44)56-32/h18-22,26-28,32,44,51-52H,3-15H2,1-2H3,(H,37,53)(H,38,54)(H,39,45)(H,40,46)(H,41,47)(H,42,55)(H,43,48)(H,49,50)(H4,34,35,36)/t19-,20-,21-,22+,26+,27+,28+,32+/m0/s1
InChI key: QELLOCUFYTYBBC-SJKYXDBVSA-N
SMILES: CC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC1CCCCC1)C(=O)NCC(=O)N[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(=O)C
Systematic name  (3):
  • Ac-L-Arg-Gly-L-Asp-3-シクロヘキシル-L-Ala-Gly-[2-(アセチルアミノ)-2-デオキシ-β-D-グルコピラノシル]NH2
  • (3S)-3-{2-[(2S)-5-カルバムイミドアミド-2-アセトアミドペンタンアミド]アセトアミド}-3-{[(1S)-2-シクロヘキシル-1-[({[(2R,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]カルバモイル}メチル)カルバモイル]エチル]カルバモイル}プロパン酸
  • (3S)-3-{2-[(2S)-5-carbamimidamido-2-acetamidopentanamido]acetamido}-3-{[(1S)-2-cyclohexyl-1-[({[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]carbamoyl}methyl)carbamoyl]ethyl]carbamoyl}propanoic acid
Other name (3):
  • Ac-L-Arg-Gly-L-Asp-3-Cyclohexyl-L-Ala-Gly-[2-(acetylamino)-2-deoxy-β-D-glucopyranosyl]NH2
  • [Cha4,Gly5]-Ac-RGDFP-NH-GlcNAc
  • Ac-Arg-Gly-Asp-Cha-Gly-NH-GlcNAc
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