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Cyclo(-Arg-Ala-Asp-D-Phe-Cys)

* Please kindly note that our products are not to be used for therapeutic purposes and cannot be sold to patients.

Cyclo(-Arg-Ala-Asp-D-Phe-Cys) is a control peptide for the αvβ3 integrin binding cyclic RGD peptide c(RGDfC).

Category

Others

Catalog number

BAT-014618

CAS number

1055991-02-0

Molecular Formula

C25H36N8O7S

Molecular Weight

592.68

Specification
Reference Reading

IUPAC Name

2-[(2S,5R,8R,11S,14S)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-14-methyl-3,6,9,12,15-pentaoxo-8-(sulfanylmethyl)-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid

Synonyms

c(RADfC); Cyclo(L-alanyl-L-α-aspartyl-D-phenylalanyl-L-cysteinyl-L-arginyl)

Appearance

White or Off-white Lyophilized Powder

Purity

≥95%

Density

1.52±0.1 g/cm3

Sequence

cyclo[Ala-Asp-D-Phe-Cys-Arg]

Storage

Store at -20°C

Solubility

Soluble in DMSO, Water

InChI

InChI=1S/C25H36N8O7S/c1-13-20(36)31-17(11-19(34)35)23(39)32-16(10-14-6-3-2-4-7-14)22(38)33-18(12-41)24(40)30-15(21(37)29-13)8-5-9-28-25(26)27/h2-4,6-7,13,15-18,41H,5,8-12H2,1H3,(H,29,37)(H,30,40)(H,31,36)(H,32,39)(H,33,38)(H,34,35)(H4,26,27,28)/t13-,15-,16+,17-,18-/m0/s1

InChI Key

LPGMHCBATHLBCF-JFMONLCZSA-N

Canonical SMILES

CC1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCN=C(N)N)CS)CC2=CC=CC=C2)CC(=O)O

1. Rupatadine

Manpreet Kaur, Jerry P Jasinski, Zane A Luopa, Neeraj Kumar, Nilesh G Patel, Omprakash Gudaparthi, H S Yathirajan Acta Crystallogr Sect E Struct Rep Online. 2013 May 31;69(Pt 6):o980. doi: 10.1107/S1600536813014256. Print 2013 Jun 1.

8-chloro-11-{1-[(5-methyl-pyridin-3-yl)meth-yl]piperidin-4-yl-idene}-6,11-di-hydro-5H-benzo[5,6]cyclo-hepta-[1,2-b]pyridine), C26H26ClN3, the dihedral angle between the mean planes of the chloro-phenyl and cyclo-hepta-[1,2-b]pyridinyl rings fused to the cyclo-heptane ring is 56.6 (1)°. The mean planes of the cyclo-hepta-[1,2-b]pyridinyl and 5-methyl-pyridin-3-yl rings are twisted by 64.9 (4)°. The central piperizene group is in a slightly distorted chair configuration. A weak intra-molecular C-H⋯N inter-action is observed between the cyclo-hepta-[1,2-b]pyridinyl and piperidin-4-yl-idene moieties.