Oxytocin Acetate

Chemistry

Field	Value
Compound class	Cyclic nonapeptide (9 aa, disulfide bridge)
Identity	Sequence: Cys-Tyr-Ile-Gln-Asn-Cys-Pro-Leu-Gly-NH₂ (disulfide bridge Cys¹↔Cys⁶)
Formula	C₄₅H₇₀N₁₂O₁₄S₂ (acetate) \| C₄₃H₆₆N₁₂O₁₂S₂ (base)
Molecular weight	1007.19 (base) \| ~1067 (acetate)
CAS	6233-83-6 (acetate) \| 50-56-6 (base)
PubChem	PubChem CID 12004215 (opens in a new tab)

Structure

PubChem properties

Property	Value
IUPAC name	acetic acid;(2S)-1-[(4R,7S,10S,13S,16S,19R)-19-amino-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]pyrrolidine-2-carboxamide
Molecular weight	1067.2
Exact mass	1066.45758730
TPSA	487
InChIKey	DSZOEVVLZMNAEH-BXUJZNQYSA-N
SMILES	CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N1)CC2=CC=C(C=C2)O)N)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N.CC(=O)O

Synonyms

Oxytocin acetate, 6233-83-6, UNII-4NR672T8NL, DTXSID1046552, EINECS 228-347-5, 4NR672T8NL, DTXCID9026552, Oxytocin Monoacetate, Oxytocin identification, RefChem:55803, OXYTOCIN, ACETATE (1:1), OXYTOCIN IDENTIFICATION (USP-RS), acetic acid;(2S)-1-[(4R,7S,10S,13S,16S,19R)-19-amino-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]pyrrolidine-2-carboxamide, C45H70N12O14S2, 6233-83-6 (acetate), Hyphot ocin, Oxytocin, acetate (1:1); Oxytocin, acetate (7CI); Oxytocin, monoacetate (salt) (8CI,9CI); 1,2-Dithia-5,8,11,14,17-pentaazacycloeicosane, cyclic peptide deriv.; Oxytocin acetate (salt), Orasthin; Ossitocina, NCGC00166145-02, SCHEMBL2126148, CHEMBL3185709, Tox21_112339, AKOS030526861, AT13256, CCG-270627

Products containing this compound

Product	Milligrams
Oxytocin Acetate	entire fill