Chemical Compound

methyl (2S)-6-amino-2-({4-[7,12-bis(4-{[(1S)-5-amino-1-[(5-aminopentyl)carbamoyl]pentyl]carbamoyl}phenyl)-17-(4-{[(2S)-6-amino-1-methoxy-1-oxohexan-2-yl]carbamoyl}phenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]phenyl}formamido)hexanoate

methyl (2S)-6-amino-2-({4-[7,12-bis(4-{[(1S)-5-amino-1-[(5-aminopentyl)carbamoyl]pentyl]carbamoyl}phenyl)-17-(4-{[(2S)-6-amino-1-methoxy-1-oxohexan-2-yl]carbamoyl}phenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]phenyl}formamido)hexanoate 结构式
Primary record

methyl (2S)-6-amino-2-({4-[7,12-bis(4-{[(1S)-5-amino-1-[(5-aminopentyl)carbamoyl]pentyl]carbamoyl}phenyl)-17-(4-{[(2S)-6-amino-1-methoxy-1-oxohexan-2-yl]carbamoyl}phenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]phenyl}formamido)hexanoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177584918
SMILES
COC(=O)[C@H](CCCCN)NC(=O)C1=CC=C(C=C1)C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=NC(=C(C6=CC=C2N6)C7=CC=C(C=C7)C(=O)N[C@@H](CCCCN)C(=O)OC)C=C5)C8=CC=C(C=C8)C(=O)N[C@@H](CCCCN)C(=O)NCCCCCN)N4)C9=CC=C(C=C9)C(=O)N[C@@H](CCCCN)C(=O)NCCCCCN
Canonical SMILES
COC(=O)[C@H](CCCCN)NC(=O)c1ccc(-c2c3nc(c(-c4ccc(C(=O)N[C@@H](CCCCN)C(=O)NCCCCCN)cc4)c4ccc([nH]4)c(-c4ccc(C(=O)N[C@@H](CCCCN)C(=O)NCCCCCN)cc4)c4nc(c(-c5ccc(C(=O)N[C@@H](CCCCN)C(=O)OC)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

名称与同义词

  • J2.292.368D
  • 5,20-Bis[4-[[(S)-1-(methoxycarbonyl)-5-aminopentyl]carbamoyl]phenyl]-10,15-bis[4-[[(S)-1-(5-aminopentylcarbamoyl)-5-aminopentyl]carbamoyl]phenyl]-21H,23H-porphyrin
  • methyl (2S)-6-amino-2-({4-[7,12-bis(4-{[(1S)-5-amino-1-[(5-aminopentyl)carbamoyl]pentyl]carbamoyl}phenyl)-17-(4-{[(2S)-6-amino-1-methoxy-1-oxohexan-2-yl]carbamoyl}phenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]phenyl}formamido)hexanoate