oxytocin, 1-deaminopenicillamine-

Modify Date: 2024-01-15 20:19:18

oxytocin, 1-deaminopenicillamine- Structure
oxytocin, 1-deaminopenicillamine- structure
Common Name oxytocin, 1-deaminopenicillamine-
CAS Number 6663-74-7 Molecular Weight 1020.226
Density 1.2±0.1 g/cm3 Boiling Point 1495.2±65.0 °C at 760 mmHg
Molecular Formula C45H69N11O12S2 Melting Point N/A
MSDS N/A Flash Point 858.1±34.3 °C

 Names

Name 1-{[(4R,7S,13S,16R)-7-(2-Amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-2-butanyl]-16-(4-hydroxybenzyl)-20,20-dimethyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbonyl}-L-prolyl-L-leucylglycinamide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 1495.2±65.0 °C at 760 mmHg
Molecular Formula C45H69N11O12S2
Molecular Weight 1020.226
Flash Point 858.1±34.3 °C
Exact Mass 1019.456848
PSA 424.11000
LogP -2.55
Vapour Pressure 0.0±0.3 mmHg at 25°C
Index of Refraction 1.544
InChIKey IZIWNJRAVSDMFB-DEOFYFBKSA-N
SMILES CCC(C)C1NC(=O)C(Cc2ccc(O)cc2)NC(=O)CC(C)(C)SSCC(C(=O)N2CCCC2C(=O)NC(CC(C)C)C(=O)NCC(N)=O)NC(=O)C(CC(N)=O)NC(=O)C(CCC(N)=O)NC1=O

 Synonyms

Glycinamide, 1-[[(4R,7S,13S,16R)-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-16-[(4-hydroxyphenyl)methyl]-20,20-dimethyl-13-[(1S)-1-methylpropyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloeicos-4-yl]carbonyl]-L-prolyl-L-leucyl-
1-{[(4R,7S,13S,16R)-7-(2-Amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-2-butanyl]-16-(4-hydroxybenzyl)-20,20-dimethyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbonyl}-L-prolyl-L-leucylglycinamide
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