Products 1412-99-3

CAS 1412-99-3 is the registry number for Pinifolic acid - Pinus sylvestris (Scots pine). Offered by: Biosynth. Available pack sizes: 2mg, 5mg, 10mg, 25mg.

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

(1R,4aR,5S,8aR)-5-[(3S)-4-carboxy-3-methylbutyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (CAS 1412-99-3) is a chemical compound with the molecular formula C20H32O4 and a molecular weight of 336.5 g/mol. IUPAC name: (1R,4aR,5S,8aR)-5-[(3S)-4-carboxy-3-methylbutyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid. InChIKey: HPQKNJHVWUWAOR-QBSBYYDBSA-N.

Identity
Molecular formulaC20H32O4
Molecular weight336.5 g/mol
IUPAC name(1R,4aR,5S,8aR)-5-[(3S)-4-carboxy-3-methylbutyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
InChIKeyHPQKNJHVWUWAOR-QBSBYYDBSA-N
SMILESC[C@@H](CC[C@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@@]2(C)C(=O)O)C)CC(=O)O

Computed by PubChem (NCBI)