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Merotocin

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Specification

Cat. No.

SMD495

Related Diseases

Autism

Product Name

Merotocin

Size

Customizable

Price

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Description

Merotocin is a peptidic agonist of the oxytocin receptor that was derived from oxytocin. It may be investigated for use as treatment of preterm mothers with lactation failure requiring lactation support. Merotocin is potent and highly selective.

CAS Number

1190083-57-8

Chemical Formula

C48H68FN11O12S

Exact Mass

1041.4754

Molecular Weight

1042.2

Elemental Analysis

C, 55.32; H, 6.58; F, 1.82; N, 14.78; O, 18.42; S, 3.08

Synonym

Merotocin; FE202767; FE-202767; FE 202767

IUPAC/Chemical Name

(3R,6S,9S,12S,15S)-6-(2-amino-2-oxoethyl)-N-(2-(((S)-1-((2-amino-2-oxoethyl)amino)-4-methyl-1-oxopentan-2-yl)amino)-2-oxoethyl)-9-(3-amino-3-oxopropyl)-12-((S)-sec-butyl)-N-(4-fluorobenzyl)-15-(4-hydroxybenzyl)-5,8,11,14,17-pentaoxo-1-thia-4,7,10,13,16-pentaazacycloicosane-3-carboxamide

InChi Key

PVVHQWISMVJHFK-NIFJBHDKSA-N

InChi Code

InChI=1S/C48H68FN11O12S/c1-5-27(4)42-47(71)56-32(16-17-37(50)62)44(68)57-35(21-38(51)63)45(69)58-36(25-73-18-6-7-40(65)54-34(46(70)59-42)20-28-10-14-31(61)15-11-28)48(72)60(23-29-8-12-30(49)13-9-29)24-41(66)55-33(19-26(2)3)43(67)53-22-39(52)64/h8-15,26-27,32-36,42,61H,5-7,16-25H2,1-4H3,(H2,50,62)(H2,51,63)(H2,52,64)(H,53,67)(H,54,65)(H,55,66)(H,56,71)(H,57,68)(H,58,69)(H,59,70)/t27-,32-,33-,34-,35-,36-,42-/m0/s1

SMILES Code

O=C([C@@H](NC([C@H](CC(N)=O)NC([C@H](CCC(N)=O)NC([C@H]([C@@H](C)CC)NC([C@H](CC1=CC=C(O)C=C1)N2)=O)=O)=O)=O)CSCCCC2=O)N(CC(N[C@@H](CC(C)C)C(NCC(N)=O)=O)=O)CC3=CC=C(F)C=C3

Appearance

Solid powder

Purity

>98% (or refer to the Certificate of Analysis)

Shipping Condition

Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.

Storage Condition

Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

Solubility

Soluble in DMSO

Shelf Life

>2 years if stored properly

Drug Formulation

This drug may be formulated in DMSO

Stock Solution Storage

0 - 4℃ for short term (days to weeks), or -20℃ for long term (months).

HS Tariff Code

2934.99.9001

All of our services and products are intended for preclinical research use only and cannot be used to diagnose, treat or manage patients.