Products 1095009-44-1

CAS 1095009-44-1 is the registry number for LXY3. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

2-[(6S,12R,15S,20S,23S,26S,28R)-15-amino-23-(2-amino-2-oxoethyl)-20-carbamoyl-28-hydroxy-6-[(4-hydroxy-3-nitrophenyl)methyl]-2,5,8,11,14,22,25-heptaoxo-17,18-dithia-1,4,7,10,13,21,24-heptazabicyclo[24.3.0]nonacosan-12-yl]acetic acid (CAS 1095009-44-1) is a chemical compound with the molecular formula C32H43N11O15S2 and a molecular weight of 885.9 g/mol. IUPAC name: 2-[(6S,12R,15S,20S,23S,26S,28R)-15-amino-23-(2-amino-2-oxoethyl)-20-carbamoyl-28-hydroxy-6-[(4-hydroxy-3-nitrophenyl)methyl]-2,5,8,11,14,22,25-heptaoxo-17,18-dithia-1,4,7,10,13,21,24-heptazabicyclo[24.3.0]nonacosan-12-yl]acetic acid. InChIKey: VALZMCWLPCJDLL-OPUINZJVSA-N.

Identity
Molecular formulaC32H43N11O15S2
Molecular weight885.9 g/mol
IUPAC name2-[(6S,12R,15S,20S,23S,26S,28R)-15-amino-23-(2-amino-2-oxoethyl)-20-carbamoyl-28-hydroxy-6-[(4-hydroxy-3-nitrophenyl)methyl]-2,5,8,11,14,22,25-heptaoxo-17,18-dithia-1,4,7,10,13,21,24-heptazabicyclo[24.3.0]nonacosan-12-yl]acetic acid
InChIKeyVALZMCWLPCJDLL-OPUINZJVSA-N
SMILESC1[C@H](CN2[C@@H]1C(=O)N[C@H](C(=O)N[C@H](CSSC[C@H](C(=O)N[C@@H](C(=O)NCC(=O)N[C@H](C(=O)NCC2=O)CC3=CC(=C(C=C3)O)[N+](=O)[O-])CC(=O)O)N)C(=O)N)CC(=O)N)O

Computed by PubChem (NCBI)

Synonyms: orb3022991