AIDS-134018

Molecular Formula: C47H85N15O14


InChI: InChI=1/C47H85N15O14/c1-10-24(7)36(50)44(74)54-20-34(66)56-27(13-12-16-53-47(51)52)39(69)60-31(19-33(49)65)42(72)58-29(17-22(3)4)41(71)59-30(18-23(5)6)43(73)62-38(26(9)63)46(76)57-28(14-15-32(48)64)40(70)61-37(25(8)11-2)45(75)55-21-35(67)68/h22-31,36-38,63H,10-21,50H2,1-9H3,(H2,48,64)(H2,49,65)(H,54,74)(H,55,75)(H,56,66)(H,57,76)(H,58,72)(H,59,71)(H,60,69)(H,61,70)(H,62,73)(H,67,68)(H4,51,52,53)/f/h54-62,67H,48-49,51-52H2

InChIKey: InChIKey=FGHZIEAGAAEKRV-RPDRHHDOCN
SMILES: CCC(C)C(C(=O)NCC(=O)NC(CCCN=C(N)N)C(=O)NC(CC(=O)N)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(C(C)O)C(=O)NC(CCC(=O)N)C(=O)NC(C(C)CC)C(=O)NCC(=O)O)N

Names:
    AIDS-134018
    AIDS134018
    NSC631183
    2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-3-methyl-pentanoyl)amino]acetyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-carbamoyl-propanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-hydroxy-butanoyl]amino]-4-carbamoyl-butanoyl]amino]-3-methyl-pentanoyl]amino]acetic acid
    29-Amino-23-(3-((amino(imino)methyl)amino)propyl)-20-(2-amino-2-oxoethyl)-8-(3-amino-3-oxopropyl)-5-sec-butyl-11-(1-hydroxyethyl)-14,17-diisobutyl-30-methyl-4,7,10,13,16,19,22,25,28-nonaoxo-3,6,9,12,1\t5,18,21,24,27-nonaazadotriacontan-1-oic acid

Registries:
    PubChem CID 364648
    PubChem ID 229967