N-pepstatinyl-S-bimanyl-2-aminoethanethiol

Modify Date: 2025-06-18 10:03:40

N-pepstatinyl-S-bimanyl-2-aminoethanethiol Structure
N-pepstatinyl-S-bimanyl-2-aminoethanethiol structure
Common Name N-pepstatinyl-S-bimanyl-2-aminoethanethiol
CAS Number 80562-33-0 Molecular Weight 935.224
Density 1.2±0.1 g/cm3 Boiling Point N/A
Molecular Formula C46H78N8O10S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name (2S,6S)-2-{[8,16-Dihydroxy-9-isobutyl-12,19-dimethyl-6,11,14-trioxo-1-(2,5,6-trimethyl-1,7-dioxo-1H,7H-pyrazolo[1,2-a]pyrazol-3-yl)-2-thia-5,10,13-triazaicosan-17-yl]amino}-3,7-dimethyl-6-[(3-methylbutanoyl)amino]-5-oxooctanamide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Molecular Formula C46H78N8O10S
Molecular Weight 935.224
Exact Mass 934.556152
LogP 3.66
Index of Refraction 1.570
InChIKey BHOCECSLAJLHGP-XFNYOZPQSA-N
SMILES Cc1c(C)n2c(CSCCNC(=O)CC(O)C(CC(C)C)NC(=O)C(C)NC(=O)CC(O)C(CC(C)C)NC(C(N)=O)C(C)CC(=O)C(NC(=O)CC(C)C)C(C)C)c(C)c(=O)n2c1=O

 Synonyms

4,7,12,18-Tetraazadocosane-1,13-dicarboxamide, 2,10-dihydroxy-6,14,21-trimethyl-17-(1-methylethyl)-3,11-bis(2-methylpropyl)-5,8,16,19-tetraoxo-N1-[2-[[(2,5,6-trimethyl-1,7-dioxo-1H,7H-pyrazolo[1,2-a ]pyrazol-3-yl)methyl]thio]ethyl]-, (13S,17S)-
(2S,6S)-2-{[8,16-Dihydroxy-9-isobutyl-12,19-dimethyl-6,11,14-trioxo-1-(2,5,6-trimethyl-1,7-dioxo-1H,7H-pyrazolo[1,2-a]pyrazol-3-yl)-2-thia-5,10,13-triazaicosan-17-yl]amino}-3,7-dimethyl-6-[(3-methylbutanoyl)amino]-5-oxooctanamide
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