oxytocin, 1-(2-hydroxy-3-mercaptopropionic acid)-
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oxytocin, 1-(2-hydroxy-3-mercaptopropionic acid)-
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CAS No:
35924-96-0
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Formula:
C43H65N11O13S2
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Chemical Name:
oxytocin, 1-(2-hydroxy-3-mercaptopropionic acid)-
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Synonyms:
1-(2-hydroxy-3-mercaptopropionic acid)-oxytocin, (D)-isomer;1-(2-hydroxy-3-mercaptopropionic acid)oxytocin;OXHMPA;oxytocin, 1-(2-hydroxy-3-mercaptopropionic acid)-;Oxhmpa;35924-96-0;1-(2-Hydroxy-3-mercaptopropionic acid)oxytocin;Oxytocin, 1-(2-hydroxy-3-mercaptopropionic acid)-;Oxytocin, 1-(L-2-hydroxy-3-mercaptopropanoic acid)-;(2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[(4R,7S,10S,16S,19R)-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-19-hydroxy-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaza
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CAS No:
Computed Properties
Molecular Weight:1008.2
XLogP3:-2.3
Hydrogen Bond Donor Count:12
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:17
Exact Mass:1007.42047352
Monoisotopic Mass:1007.42047352
Topological Polar Surface Area:444
Heavy Atom Count:69
Complexity:1870
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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