(2S,3S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-1-[(2S)-2-amino-4-methyl-pentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]propanoyl]amino]hexanoyl]amino]-4-carboxy-butanoyl]amino]-3-methyl-pentanoic acid

Molecular Formula: C46H80N10O12


InChI: InChI=1/C46H80N10O12/c1-10-27(8)37(46(67)68)54-40(61)31(18-19-34(57)58)51-39(60)30(15-11-12-20-47)50-38(59)28(9)49-42(63)35(25(4)5)53-43(64)36(26(6)7)52-41(62)32-16-13-21-55(32)45(66)33-17-14-22-56(33)44(65)29(48)23-24(2)3/h24-33,35-37H,10-23,47-48H2,1-9H3,(H,49,63)(H,50,59)(H,51,60)(H,52,62)(H,53,64)(H,54,61)(H,57,58)(H,67,68)/t27-,28-,29-,30-,31-,32-,33-,35-,36-,37-/m0/s1/f/h49-54,57,67H

InChIKey: InChIKey=APEIJRBMSUYSMP-SGULMFQODL
SMILES: CCC(C)C(C(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CCCCN)NC(=O)C(C)NC(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)C1CCCN1C(=O)C2CCCN2C(=O)C(CC(C)C)N

Names:
    (2S,3S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-1-[(2S)-2-amino-4-methyl-pentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]propanoyl]amino]hexanoyl]amino]-4-carboxy-butanoyl]amino]-3-methyl-pentanoic acid

Registries:
    PubChem CID 445208
    PubChem ID 11567785