Oxytocin, deamino-6-carba- | 30927-32-3 |oxytocin| MedKoo

MedKoo Cat#: 581620 | Name: Oxytocin, deamino-6-carba-

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Deamino-6-carba-oxytoxin (dC60), a potent oxytocin analog considered to be resistant to some of the physiologically significant enzymic systems.

Chemical Structure

Oxytocin, deamino-6-carba-

CAS#30927-32-3

Theoretical Analysis

MedKoo Cat#: 581620

Name: Oxytocin, deamino-6-carba-

CAS#: 30927-32-3

Chemical Formula: C44H67N11O12S

Exact Mass: 973.4691

Molecular Weight: 974.15

Elemental Analysis: C, 54.25; H, 6.93; N, 15.82; O, 19.71; S, 3.29

Price and Availability

This product was removed for the commercial reasons.

Related CAS #

No Data

Synonym

Oxytocin, deamino-6-carba-; beta-Deaminocystathionine-oxytocin; Deamino-6-carbaoxytocin.

IUPAC/Chemical Name

(2S)-1-((4S,7S,10S,16S)-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-((S)-sec-butyl)-16-(4-hydroxybenzyl)-6,9,12,15,18-pentaoxo-1-thia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl)-N-((S)-1-((2-amino-2-oxoethyl)amino)-4-methyl-1-oxopentan-2-yl)pyrrolidine-2-carboxamide

InChi Key

MRNKEVGKBFIFET-AHCPCVRLSA-N

InChi Code

InChI=1S/C44H67N11O12S/c1-5-24(4)37-43(66)50-27(12-13-33(45)57)39(62)52-31(21-34(46)58)40(63)51-28(14-17-68-18-15-36(60)49-30(41(64)54-37)20-25-8-10-26(56)11-9-25)44(67)55-16-6-7-32(55)42(65)53-29(19-23(2)3)38(61)48-22-35(47)59/h8-11,23-24,27-32,37,56H,5-7,12-22H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,60)(H,50,66)(H,51,63)(H,52,62)(H,53,65)(H,54,64)/t24-,27-,28-,29-,30-,31-,32-,37?/m0/s1

SMILES Code

CC[C@H](C)C1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCSCCC(=O)N[C@H](C(=O)N1)Cc2ccc(cc2)O)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N

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

>3 years if stored properly

Drug Formulation

This drug may be formulated in DMSO

Stock Solution Storage

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

HS Tariff Code

2934.99.03.00

More Info

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 974.15 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Concentration / Solvent Volume / Mass	1 mg	5 mg	10 mg
1 mM	1.15 mL	5.76 mL	11.51 mL
5 mM	0.23 mL	1.15 mL	2.3 mL
10 mM	0.12 mL	0.58 mL	1.15 mL
50 mM	0.02 mL	0.12 mL	0.23 mL

1: Krejcí I, Kupková B, Dlabac A. Passive avoidance behavior: opposite effects of oxytocin analogs with agonist and antagonist properties. Regul Pept. 1981 Sep;2(5):285-91. PubMed PMID: 7302291.