3-[22-(3-carbamimidamidopropyl)-19,67-bis(carbamoylmethyl)-25,49,64,73,88-pentakis(1-hydroxyethyl)-43-(hydroxymethyl)-40-[(1H-indol-3-yl)methyl]-13-(2-methylpropyl)-3,6,12,15,18,21,24,27,30,33,39,42,45,48,51,54,57,63,66,69,72,75,78,81,84,87,90,93,96-nonacosaoxo-4,31,82-tris(propan-2-yl)-98,99,102,103,106,107-hexathia-2,5,11,14,17,20,23,26,29,32,38,41,44,47,50,53,56,62,65,68,71,74,77,80,83,86,89,92,95-nonacosaazaheptacyclo[50.44.4.428,70.446,85.07,11.034,38.058,62]108n-91-yl]propanoic acid

化合物标识与属性

PubChem CID

177495668

SMILES

CC(C)CC1C(=O)N2CCCC2C(=O)NC(C(=O)NC3CSSCC4C(=O)NC(C(=O)NC5CSSCC(C(=O)NC(C(=O)NCC(=O)NCC(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)N1)CC(=O)N)CCCNC(=N)N)C(C)O)NC(=O)C(NC(=O)C6CCCN6C(=O)C(NC(=O)C(NC5=O)CO)CC7=CNC8=CC=CC=C87)C(C)C)C(=O)NC(C(=O)NC(C(=O)N9CCCC9C(=O)NCC(=O)N4)C(C)O)CC(=O)N)C(C)O)C(C)C)NC(=O)C(NC(=O)C(NC(=O)CNC3=O)CCC(=O)O)C(C)O)C(C)O)C(C)C

Canonical SMILES

CC(C)CC1NC(=O)CNC(=O)C(CC(N)=O)NC(=O)C(CCCNC(=N)N)NC(=O)C(C(C)O)NC(=O)C2CSSCC3NC(=O)C(C(C)O)NC(=O)CNC(=O)CNC(=O)C(C(C)C)NC(=O)C4CSSCC(NC(=O)C(C(C)O)NC(=O)C(CSSCC(NC(=O)C(C(C)C)NC(=O)C5CCCN5C1=O)C(=O)NCC(=O)NC(CCC(=O)O)C(=O)NC(C(C)O)C(=O)N4)NC(=O)CNC(=O)C1CCCN1C(=O)C(C(C)O)NC(=O)C(CC(N)=O)NC3=O)C(=O)NC(CO)C(=O)NC(Cc1c[nH]c3ccccc13)C(=O)N1CCCC1C(=O)NC(C(C)C)C(=O)N2