2-((2S,5R,8S,11S)-8-(4-Aminobutyl)-5-benzyl-11-(3-guanidinopropyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentaazacyclopentadecan-2-yl)acetic acid, 98%

cas: 161552-03-0 — see every product listed under this CAS number, including other names

2-((2S,5R,8S,11S)-8-(4-Aminobutyl)-5-benzyl-11-(3-guanidinopropyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentaazacyclopentadecan-2-yl)acetic acid, 98% (CAS 161552-03-0) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 250mg, 1g. Offered by: BLDpharm.

• 2D
• 3D

2-[(2S,5R,8S,11S)-8-(4-aminobutyl)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid (CAS 161552-03-0) is a chemical compound with the molecular formula C27H41N9O7 and a molecular weight of 603.7 g/mol. IUPAC name: 2-[(2S,5R,8S,11S)-8-(4-aminobutyl)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid. InChIKey: NVHPXYIRNJFKTE-HAGHYFMRSA-N.

Identity

Molecular formula	C27H41N9O7
Molecular weight	603.7 g/mol
IUPAC name	2-[(2S,5R,8S,11S)-8-(4-aminobutyl)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid
InChIKey	NVHPXYIRNJFKTE-HAGHYFMRSA-N
SMILES	C1C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCN=C(N)N)CCCCN)CC2=CC=CC=C2)CC(=O)O

Computed by PubChem (NCBI)

Synonyms: Cyclo(-RGDfK), Cyclo (-RGDfK), cyclo-rgdfk, Cyclo(-Arg-Gly-Asp-D-Phe-Lys), cyclo-(Arg-Gly-Asp-D-Phe-Lys), cyclo(Arg-Gly-Asp-DPhe-Lys), cyclo(Arg-Gly-Asp-D-Phe-Lys), cyclo-[Arg-Gly-Asp-d-Phe-Lys], Cyclo(RGDfK), cyclo[Arg-Gly-Asp-d-Phe-Lys]

Isomers (same molecular formula)

(5S,8R,11R,14S)-8-(4-aminobutyl)-5-[3-(diaminomethylideneamino)propyl]-7-methyl-3,6,9,12,16-pentaoxo-11-phenyl-1,4,7,10,13-pentazacyclohexadecane-14-carboxylic acid C₂₇H₄₁N₉O₇