Chemical Compound

(2S)-6-amino-2-{[(2S)-1-[(2S)-2-(2-{N-[2-(2-{2-[2-amino-6-(piperidin-1-yl)-9H-purin-9-yl]-N-(2-aminoethyl)acetamido}acetamido)ethyl]-2-(6-amino-9H-purin-9-yl)acetamido}acetamido)-4-methylpentanoyl]pyrrolidin-2-yl]formamido}-N-[(1S,2R)-1-({[({[(1S)-4-carbamimidamido-1-carbamoylbutyl]carbamoyl}methyl)carbamoyl]methyl}carbamoyl)-2-hydroxypropyl]hexanamide

(2S)-6-amino-2-{[(2S)-1-[(2S)-2-(2-{N-[2-(2-{2-[2-amino-6-(piperidin-1-yl)-9H-purin-9-yl]-N-(2-aminoethyl)acetamido}acetamido)ethyl]-2-(6-amino-9H-purin-9-yl)acetamido}acetamido)-4-methylpentanoyl]pyrrolidin-2-yl]formamido}-N-[(1S,2R)-1-({[({[(1S)-4-carbamimidamido-1-carbamoylbutyl]carbamoyl}methyl)carbamoyl]methyl}carbamoyl)-2-hydroxypropyl]hexanamide 结构式
Primary record

(2S)-6-amino-2-{[(2S)-1-[(2S)-2-(2-{N-[2-(2-{2-[2-amino-6-(piperidin-1-yl)-9H-purin-9-yl]-N-(2-aminoethyl)acetamido}acetamido)ethyl]-2-(6-amino-9H-purin-9-yl)acetamido}acetamido)-4-methylpentanoyl]pyrrolidin-2-yl]formamido}-N-[(1S,2R)-1-({[({[(1S)-4-carbamimidamido-1-carbamoylbutyl]carbamoyl}methyl)carbamoyl]methyl}carbamoyl)-2-hydroxypropyl]hexanamide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
102387673
SMILES
C[C@H]([C@@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)CN(CCNC(=O)CN(CCN)C(=O)CN2C=NC3=C2N=C(N=C3N4CCCCC4)N)C(=O)CN5C=NC6=C(N=CN=C65)N)O
Canonical SMILES
CC(C)C[C@H](NC(=O)CN(CCNC(=O)CN(CCN)C(=O)Cn1cnc2c(N3CCCCC3)nc(N)nc21)C(=O)Cn1cnc2c(N)ncnc21)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(N)=O)[C@@H](C)O

名称与同义词

  • J2.338.828F
  • (2S)-6-amino-2-{[(2S)-1-[(2S)-2-(2-{N-[2-(2-{2-[2-amino-6-(piperidin-1-yl)-9H-purin-9-yl]-N-(2-aminoethyl)acetamido}acetamido)ethyl]-2-(6-amino-9H-purin-9-yl)acetamido}acetamido)-4-methylpentanoyl]pyrrolidin-2-yl]formamido}-N-[(1S,2R)-1-({[({[(1S)-4-carbamimidamido-1-carbamoylbutyl]carbamoyl}methyl)carbamoyl]methyl}carbamoyl)-2-hydroxypropyl]hexanamide
  • N-[2-[N-(2-Amino-6-piperidino-9H-purine-9-ylacetyl)-N-(2-aminoethyl)glycylamino]ethyl]-N-(6-amino-9H-purine-9-ylacetyl)-Gly-L-Leu-L-Pro-L-Lys-L-Thr-Gly-Gly-L-Arg-NH2