Carbetocin, 98%

cas: 37025-55-1 — see every product listed under this CAS number, including other names

Carbetocin, 98% (CAS 37025-55-1) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberAIB- 37025-55-1
cas 37025-55-1
sizeon request
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properties

purity0,98
Structural formula: {0} (CAS {1})

Carbetocin is oxytocin in which the hydrogen on the phenolic hydroxy group is substituted by methyl, the amino group on the cysteine residue is substituted by hydrogen, and the sulfur of the cysteine residue is replaced by a methylene group. A synthetic carba-analogue of oxytocin, it is used to control bleeding after giving birth. Like oxytocin, it causes contraction of the uterus. It has a role as an oxytocic.

Source: ChEBI

Identity
Molecular formulaC45H69N11O12S
Molecular weight988.2 g/mol
IUPAC name(2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[(3R,6S,9S,12S,15S)-6-(2-amino-2-oxoethyl)-9-(3-amino-3-oxopropyl)-12-[(2S)-butan-2-yl]-15-[(4-methoxyphenyl)methyl]-5,8,11,14,17-pentaoxo-1-thia-4,7,10,13,16-pentazacycloicosane-3-carbonyl]pyrrolidine-2-carboxamide
InChIKeyNSTRIRCPWQHTIA-DTRKZRJBSA-N
SMILESCC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSCCCC(=O)N[C@H](C(=O)N1)CC2=CC=C(C=C2)OC)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N

Computed by PubChem (NCBI)

Synonyms: Carbetocin, Pabal, Carbetocino, Carbetocinum, Duratocin, carbetocine, Carbetocina, deamino-2-O-methyltyrosine-1-carbaoxytocin, 1-butanoic acid-2-(O-methyl-L-tyrosine)-1-carbaoxytocin, 1-Butyric acid-2-(3-(p-methoxyphenyl)-L-alanine)oxytocin

Also listed as

1-Butanoic acid-2-(O-methyl-L-tyrosine)-1-carbaoxytocin Biosynth CAS 37025-55-1
Carbetocin Chemat Brand CAS 37025-55-1
Carbetocin, >95% (HPLC) TRC CAS 37025-55-1
Glycinamide, N-(4-mercapto-1-oxobutyl)-O-methyl-L-tyrosyl-L-isoleucyl-L-glutaminyl-L-asparaginyl-L-cysteinyl-L-prolyl-L-leucyl-, cyclic (1→5)-thioether, 95%, 95% Chemat CAS 37025-55-1
Carbetocin, 99.97% MedChemExpress CAS 37025-55-1
Carbetocin Acetate Chemat Brand CAS 37025-55-1(free base)