Products 149475-21-8

CAS 149475-21-8 is the registry number for CDR-H3/C2. Offered by: Biosynth. Available pack sizes: 1000ug, 500ug, 2000ug.

Structural formula: {0} (CAS {1})

(4R,7S,10S,13S,16S,19S,22S,25S,28S,31S,34S,37S,40S,43S,46S,49R)-49-amino-10-benzyl-40-[(2S)-butan-2-yl]-22,25-bis(2-carboxyethyl)-7,19,31,46-tetrakis(carboxymethyl)-13,16,28,34,37-pentakis[(4-hydroxyphenyl)methyl]-43-(2-methylpropyl)-6,9,12,15,18,21,24,27,30,33,36,39,42,45,48-pentadecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35,38,41,44,47-pentadecazacyclopentacontane-4-carboxylic acid (CAS 149475-21-8) is a chemical compound with the molecular formula C98H120N16O34S2 and a molecular weight of 2130.2 g/mol. IUPAC name: (4R,7S,10S,13S,16S,19S,22S,25S,28S,31S,34S,37S,40S,43S,46S,49R)-49-amino-10-benzyl-40-[(2S)-butan-2-yl]-22,25-bis(2-carboxyethyl)-7,19,31,46-tetrakis(carboxymethyl)-13,16,28,34,37-pentakis[(4-hydroxyphenyl)methyl]-43-(2-methylpropyl)-6,9,12,15,18,21,24,27,30,33,36,39,42,45,48-pentadecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35,38,41,44,47-pentadecazacyclopentacontane-4-carboxylic acid. InChIKey: DEXYGHUAFZRBPN-KRKQNTPWSA-N.

Identity
Molecular formulaC98H120N16O34S2
Molecular weight2130.2 g/mol
IUPAC name(4R,7S,10S,13S,16S,19S,22S,25S,28S,31S,34S,37S,40S,43S,46S,49R)-49-amino-10-benzyl-40-[(2S)-butan-2-yl]-22,25-bis(2-carboxyethyl)-7,19,31,46-tetrakis(carboxymethyl)-13,16,28,34,37-pentakis[(4-hydroxyphenyl)methyl]-43-(2-methylpropyl)-6,9,12,15,18,21,24,27,30,33,36,39,42,45,48-pentadecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35,38,41,44,47-pentadecazacyclopentacontane-4-carboxylic acid
InChIKeyDEXYGHUAFZRBPN-KRKQNTPWSA-N
SMILESCC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC(C)C)CC(=O)O)N)C(=O)O)CC(=O)O)CC2=CC=CC=C2)CC3=CC=C(C=C3)O)CC4=CC=C(C=C4)O)CC(=O)O)CCC(=O)O)CCC(=O)O)CC5=CC=C(C=C5)O)CC(=O)O)CC6=CC=C(C=C6)O)CC7=CC=C(C=C7)O

Computed by PubChem (NCBI)