Products 76177-99-6

CAS 76177-99-6 appears in our catalog under these names: Fenretinide Glucuronide Monosodium Salt, Fenretinide Glucuronide Sodium Salt. Offered by: TRC. Available pack sizes: 500mg, 25mg.

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

Sodium (2S,3S,4S,5R,6S)-6-[4-[[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoyl]amino]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylate (CAS 76177-99-6) is a chemical compound with the molecular formula C32H40NNaO8 and a molecular weight of 589.7 g/mol. IUPAC name: sodium (2S,3S,4S,5R,6S)-6-[4-[[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoyl]amino]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylate. InChIKey: SASCRNMSPJBDPA-MIBKJGKNSA-M.

Identity
Molecular formulaC32H40NNaO8
Molecular weight589.7 g/mol
IUPAC namesodium (2S,3S,4S,5R,6S)-6-[4-[[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoyl]amino]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylate
InChIKeySASCRNMSPJBDPA-MIBKJGKNSA-M
SMILESCC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)NC2=CC=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)[O-])O)O)O)/C)/C.[Na+]

Computed by PubChem (NCBI)