AIDS-134005

Molecular Formula: C46H72N12O15


InChI: InChI=1/C46H72N12O15/c1-23(2)17-30(41(68)51-21-38(64)65)54-43(70)31(19-26-8-10-27(60)11-9-26)55-44(71)33(22-59)57-42(69)29(13-15-36(49)62)53-45(72)34-7-6-16-58(34)46(73)32(18-24(3)4)56-39(66)25(5)52-37(63)20-50-40(67)28(47)12-14-35(48)61/h8-11,23-25,28-34,59-60H,6-7,12-22,47H2,1-5H3,(H2,48,61)(H2,49,62)(H,50,67)(H,51,68)(H,52,63)(H,53,72)(H,54,70)(H,55,71)(H,56,66)(H,57,69)(H,64,65)/f/h50-57,64H,48-49H2

InChIKey: InChIKey=QNKLVHVOZUOCMI-FMOLCJGFCB
SMILES: CC(C)CC(C(=O)NCC(=O)O)NC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C(CO)NC(=O)C(CCC(=O)N)NC(=O)C2CCCN2C(=O)C(CC(C)C)NC(=O)C(C)NC(=O)CNC(=O)C(CCC(=O)N)N

Names:
    AIDS-134005
    AIDS134005
    NSC631170
    2-[[2-[[2-[[2-[[2-[[1-[2-[2-[[2-[(2-amino-4-carbamoyl-butanoyl)amino]acetyl]amino]propanoylamino]-4-methyl-pentanoyl]pyrrolidine-2-carbonyl]amino]-4-carbamoyl-butanoyl]amino]-3-hydroxy-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methyl-pentanoyl]amino]acetic acid
    3-(3-Amino-3-oxopropyl)-1-(1-(2-((2-((((2,5-diamino-5-oxopentanoyl)amino)acetyl)amino)propanoyl)amino)-4-methylpentanoyl)-2-pyrrolidinyl)-9-(4-hydroxybenzyl)-6-(hydroxymethyl)-12-isobutyl-1,4,7,10,13-\tpentaoxo-2,5,8,11,14-pentaazahexadecan-16-oic acid

Registries:
    PubChem CID 364635
    PubChem ID 229954