AIDS-134576

Molecular Formula: C₄₈H₇₄N₁₄O₁₈

InChI: InChI=1/C48H74N14O18/c1-22(2)13-33(48(79)80)59-43(74)31(15-26-18-52-21-53-26)57-44(75)32(17-36(51)67)58-47(78)38(24(4)65)62-46(77)35(20-64)61-42(73)30(14-25-8-10-27(66)11-9-25)56-45(76)34(19-63)60-39(70)23(3)54-41(72)29(7-5-6-12-49)55-40(71)28(50)16-37(68)69/h8-11,18,21-24,28-35,38,63-66H,5-7,12-17,19-20,49-50H2,1-4H3,(H2,51,67)(H,52,53)(H,54,72)(H,55,71)(H,56,76)(H,57,75)(H,58,78)(H,59,74)(H,60,70)(H,61,73)(H,62,77)(H,68,69)(H,79,80)/f/h53-62,68,79H,51H2

InChIKey: InChIKey=FRMVVVMBVGQNJE-BSXBQYSKCJ
SMILES: CC(C)CC(C(=O)O)NC(=O)C(CC1=CN=CN1)NC(=O)C(CC(=O)N)NC(=O)C(C(C)O)NC(=O)C(CO)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C(CO)NC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(CC(=O)O)N

Names:
    AIDS-134576
    AIDS134576
    NSC633079
    2-[[2-[[2-[[2-[[2-[[2-[[2-[2-[[6-amino-2-[(2-amino-3-carboxy-propanoyl)amino]hexanoyl]amino]propanoylamino]-3-hydroxy-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-3-hydroxy-butanoyl]amino]-3-carbamoyl-propanoyl]amino]-3-(3H-imidazol-4-yl)propanoyl]amino]-4-methyl-pentanoic acid
    29-Amino-26-(4-aminobutyl)-8-(2-amino-2-oxoethyl)-17-(4-hydroxybenzyl)-11-(1-hydroxyethyl)-14,20-bis(hydroxymethyl)-5-(1H-imidazol-4-ylmethyl)-2-isobutyl-23-methyl-4,7,10,13,16,19,22,25,28-nonaoxo-3,6\t,9,12,15,18,21,24,27-nonaazahentriacontane-1,31-dioic acid

Registries:
    PubChem CID 365449
    PubChem ID 230525