113789-43-8
113789-43-8 structure
- Name: oxytocin, 1'-(1'-thio-4'-methylcyclohexane)acetic acid-
- Chemical Name: (2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[(10R,13S,16S,22S)-13-(2-amino-2-oxoethyl)-16-(3-amino-3-oxopropyl)-19-[(2S)-butan-2-yl]-22-[(4-hydroxyphenyl)methyl]-3-methyl-12,15,18,21,24-pentaoxo-7,8-dithia-11,14,17,20,23-pentaz
- CAS Number: 113789-43-8
- Molecular Formula: C49H75N11O12S2
- Molecular Weight: 1074.32000
- Create Date: 2016-12-07 22:52:52
- Modify Date: 2022-08-30 18:16:11
| Name | (2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[(10R,13S,16S,22S)-13-(2-amino-2-oxoethyl)-16-(3-amino-3-oxopropyl)-19-[(2S)-butan-2-yl]-22-[(4-hydroxyphenyl)methyl]-3-methyl-12,15,18,21,24-pentaoxo-7,8-dithia-11,14,17,20,23-pentaz |
|---|---|
| Synonyms |
1'-(1'-Thio-4'-methylcyclohexane)acetic acid oxytocin
Oxytocin,1-(1-mercapto-4-methylcyclohexaneacetic acid) Mecaot Oxytocin,1'-(1'-thio-4'-methylcyclohexane)acetic acid (2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[(10S,16S,19S,22R)-19-(2-amino-2-oxoethyl)-16-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-10-[(4-hydroxyphenyl)methyl]-3-methyl-8,11,14,17,20-pentaoxo-24,25-dithia-9,12,15,18,21-pentazaspiro[5.19]pentacosane-22-carbonyl]pyrrolidine-2 |
| Density | 1.35g/cm3 |
|---|---|
| Boiling Point | 1516.7ºC at 760mmHg |
| Molecular Formula | C49H75N11O12S2 |
| Molecular Weight | 1074.32000 |
| Flash Point | 871.1ºC |
| Exact Mass | 1073.50000 |
| PSA | 451.51000 |
| LogP | 5.85020 |
| Vapour Pressure | 0mmHg at 25°C |
| Index of Refraction | 1.622 |