[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methyl 5-[(2S)-2-{[(3S,6S,9S,12R,17R,20S,23S,26S,29R,34aS)-17-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-3-(4-hydroxyphenyl)propanamido]-9,26,29-tris(4-aminobutyl)-6,23-bis(3-carbamimidamidopropyl)-3,20-bis[(4-hydroxyphenyl)methyl]-1,4,7,10,18,21,24,27,30-nonaoxo-dotriacontahydropyrrolo[2,1-p]1,2-dithia-5,8,11,14,17,20,23,26,29-nonaazacyclodotriacontan-12-yl]formamido}-5-carbamimidamidopentanamido]-5-oxopentanoate

化合物标识与属性

PubChem CID

177555981

SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COC(=O)CCCC(=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C3CSSC[C@@H](C(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)N[C@@H](C(=O)N4CCC[C@H]4C(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)N3)CCCCN)CCCNC(=N)N)CC5=CC=C(C=C5)O)CCCCN)CCCCN)CCCNC(=N)N)CC6=CC=C(C=C6)O)NC(=O)[C@H](CC7=CC=C(C=C7)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)N)N=[N+]=[N-]

Canonical SMILES

Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](COC(=O)CCCC(=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C3CSSC[C@H](NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)NC(Cc4ccc(O)cc4)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCCN)C(=O)N[C@H](CCCCN)C(=O)N4CCC[C@H]4C(=O)NC(Cc4ccc(O)cc4)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCCN)C(=O)N3)O2)c(=O)[nH]c1=O