CAS RN 50-56-6
CAS RN 50-56-6
IUPAC Name:
(2S)-2-{[(2S)-1-[(4R,7S,10S,13S,16S,19R)-19-amino-13-[(2S)-butan-2-yl]-10-(2-carbamoylethyl)-7-(carbamoylmethyl)-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl]pyrrolidin-2-yl]formamido}-N-(carbamoylmethyl)-4-methylpentanamide
Synonyms:
oxytocin ocytocin oxitocina endopituitrina oxytocine syntocinon OXT piton S pitocin (parke-davis) orasthin
Molecular Weight (g/mol):
1007.19
Molecular Formula:
C43H66N12O12S2
InChi Key:
XNOPRXBHLZRZKH-DSZYJQQASA-N
SMILES:
CC[C@H](C)[C@@H]1NC(=O)[C@H](CC2=CC=C(O)C=C2)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
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Oxytocin, 96%
CAS: 50-56-6 Molecular Formula: C45H67F3N12O14S2 Molecular Weight (g/mol): 1121.216 MDL Number: MFCD00076731 InChI Key: HCWNGYCIMQIGKC-BXUJZNQYSA-N Synonym: oxytocin acetate syntocinon / PubChem CID: 87795236 IUPAC Name: (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]- SMILES: CCC(C)C1C(=O)NC(C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)N1)CC2=CC=C(C=C2)O)N)C(=O)N3CCCC3C(=O)NC(CC(C)C)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N.C(=O)(C(F)(F)F)O