Products 1397-77-9

CAS 1397-77-9 is the registry number for Actinorhodin. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

Actinorhodin is a member of the class of benzoisochromanequinone that is produced by Streptomyces coelicolor A3(2) and exhibits antibiotic activity. It has a role as an antimicrobial agent and a bacterial metabolite. It is a member of p-quinones, a polyketide, a polyphenol, a dicarboxylic acid, a ring assembly and a benzoisochromanequinone. It is a conjugate acid of an actinorhodin(3-).

Source: ChEBI

Identity
Molecular formulaC32H26O14
Molecular weight634.5 g/mol
IUPAC name2-[(1R,3S)-8-[(1R,3S)-3-(carboxymethyl)-5,6,9,10-tetrahydroxy-1-methyl-3,4-dihydro-1H-benzo[g]isochromen-8-yl]-1-methyl-5,6,9,10-tetraoxo-3,4-dihydro-1H-benzo[g]isochromen-3-yl]acetic acid
InChIKeyMGFJRQUGYNFFDQ-WYUUTHIRSA-N
SMILESC[C@@H]1C2=C(C[C@H](O1)CC(=O)O)C(=O)C3=C(C2=O)C(=O)C(=CC3=O)C4=CC(=C5C(=C4O)C(=C6[C@H](O[C@@H](CC6=C5O)CC(=O)O)C)O)O

Computed by PubChem (NCBI)