1-Butanoic acid-2-(O-methyl-L-tyrosine)-1-carbaoxytocin

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

1-Butanoic acid-2-(O-methyl-L-tyrosine)-1-carbaoxytocin (CAS 37025-55-1) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 25mg, 50mg, 100mg. Offered by: Biosynth.

brandBiosynth
catalog numberFB19694-10mg
cas37025-55-1
size10mg
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Available pack sizes

brand size price
Biosynth 10mg price on request
Biosynth 25mg price on request
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Biosynth 100mg price on request

properties

categoryResearch Chemicals
sub-category 1Building Blocks
sub-category 2Amino Acids and Derivatives
purityNo data
delivery time1-2 weeks
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)

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