Products 141863-45-8

CAS 141863-45-8 appears in our catalog under these names: JMV 449 acetate, JMV 449 (acetate), 99.91%, 99.91%, JMV 449 (acetate), 99.69%. Offered by: GLPBio, Chemat, MedChemExpress. Available pack sizes: 1mg, 5mg, 10 mg, 5 mg, 1 mg.

Structural formula: {0} (CAS {1})

Acetic acid;(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2,6-diaminohexyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoic acid (CAS 141863-45-8) is a chemical compound with the molecular formula C40H70N8O9 and a molecular weight of 807.0 g/mol. IUPAC name: acetic acid;(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2,6-diaminohexyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoic acid. InChIKey: JWAZBOKEQASLBT-ULBMXYNPSA-N.

Identity
Molecular formulaC40H70N8O9
Molecular weight807.0 g/mol
IUPAC nameacetic acid;(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2,6-diaminohexyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoic acid
InChIKeyJWAZBOKEQASLBT-ULBMXYNPSA-N
SMILESCC[C@H](C)[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC[C@H](CCCCN)N.CC(=O)O

Computed by PubChem (NCBI)