Glycinamide, N-[(1-mercaptocyclohexyl)acetyl]-L-tyrosyl-L-isoleucyl-L-threonyl-L-asparaginyl-L-cysteinyl-L-prolyl-L-leucyl-, cyclic (1→5)-disulfide (9CI)
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![Glycinamide, N-[(1-mercaptocyclohexyl)acetyl]-L-tyrosyl-L-isoleucyl-L-threonyl-L-asparaginyl-L-cysteinyl-L-prolyl-L-leucyl-, cyclic (1→5)-disulfide (9CI) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/0386b16c447f45968ce594fce6ad05bc.png "Glycinamide, N-[(1-mercaptocyclohexyl)acetyl]-L-tyrosyl-L-isoleucyl-L-threonyl-L-asparaginyl-L-cysteinyl-L-prolyl-L-leucyl-, cyclic (1→5)-disulfide (9CI)")
Glycinamide, N-[(1-mercaptocyclohexyl)acetyl]-L-tyrosyl-L-isoleucyl-L-threonyl-L-asparaginyl-L-cysteinyl-L-prolyl-L-leucyl-, cyclic (1→5)-disulfide (9CI)
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CAS No:
70056-23-4
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Formula:
C47H72N10O12S2
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Chemical Name:
Glycinamide, N-[(1-mercaptocyclohexyl)acetyl]-L-tyrosyl-L-isoleucyl-L-threonyl-L-asparaginyl-L-cysteinyl-L-prolyl-L-leucyl-, cyclic (1→5)-disulfide (9CI)
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Synonyms:
Oxytocin, 1-(1-mercaptocyclohexaneacetic acid)-4-L-threonine-;70056-23-4;(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)-19-[(2S)-butan-2-yl]-16-[(1R)-1-hydroxyethyl]-22-[(4-hydroxyphenyl)methyl]-12,15,18,21,24-pentaoxo-7,8-dithia-11,14,17,20,23-pentazaspiro[5.
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CAS No:
Glycinamide, N-[(1-mercaptocyclohexyl)acetyl]-L-tyrosyl-L-isoleucyl-L-threonyl-L-asparaginyl-L-cysteinyl-L-prolyl-L-leucyl-, cyclic (1→5)-disulfide (9CI) Basic Attributes
1033.3 g/mol
1032.47726012 g/mol
Computed Properties
Molecular Weight:1033.3
XLogP3:1
Hydrogen Bond Donor Count:11
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:15
Exact Mass:1032.47726012
Monoisotopic Mass:1032.47726012
Topological Polar Surface Area:401
Heavy Atom Count:71
Complexity:1920
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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