Larazotide Acetate
acetic acid;2-[[(2S)-1-[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]acetic acid
Molecular Identity
Larazotide Acetate
acetic acid;2-[[(2S)-1-[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]acetic acid
PubChem CID: 44146842
2D Structure
Properties
C34H59N9O12
Molecular Formula
785.90
Molecular Weight
g/mol
785.4283
Exact Mass
Da
339
TPSA
May have limited oral absorption
10
H-Bond Donors
13
H-Bond Acceptors
1320
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)CC(C(=O)NC(C(C)C)C(=O)NC(CCC(=O)N)C(=O)N1CCCC1C(=O)NCC(=O)O)NC(=O)C(C(C)C)NC(=O)CNC(=O)CN.CC(=O)OIsomeric SMILES
SMILES: CC(C)C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)CN.CC(=O)OSynonyms(20)
Larazotide acetate881851-50-9FO8S2IW40NAT-1001 (LARAZOTIDE ACETATE)Glycylglycyl-L-valyl-L-leucyl-L-valyl-L-glutaminyl-L-prolylglycine acetateZot protein, Vibrio cholerae (288-293)RefChem:152364Larazotide (acetate)UNII-FO8S2IW40NLarazotide acetate [USAN]AT-1001DTXSID401007986acetic acid;2-[[(2S)-1-[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]acetic acidCS-8047D09352
Data from PubChem (NCBI)
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