oxytocin, 1-desaminopenicillamyl-phenylalanyl(2)-
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oxytocin, 1-desaminopenicillamyl-phenylalanyl(2)-
structure -
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CAS No:
72915-15-2
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Formula:
C45H69N11O11S2
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Chemical Name:
oxytocin, 1-desaminopenicillamyl-phenylalanyl(2)-
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Synonyms:
1-deaminopenicillamine-2-Phe-oxytocin;OXAPP;oxytocin, 1-desaminopenicillamyl-Phe(2)-;oxytocin, 1-desaminopenicillamyl-phenylalanyl(2)-;OXAPP;1-Deaminopenicillamine-2-phe-oxytocin;Oxytocin, 1-desaminopenicillamyl-phe(2)-;Oxytocin, 1-desaminopenicillamyl-phenylalanyl(2)-;SCHEMBL15512272;72915-15-2;N-[1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-16-benzyl-13-butan-2-yl-20,20-dimethyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide;Oxytocin, 1-(3-mercapto-3-methylbutanoic acid)-2-L-phenylalanine-
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CAS No:
Computed Properties
Molecular Weight:1004.2
XLogP3:-0.8
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:17
Exact Mass:1003.46194441
Monoisotopic Mass:1003.46194441
Topological Polar Surface Area:404
Heavy Atom Count:69
Complexity:1880
Undefined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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