Basic information
- CAS
18499-84-8- Standard SMILES
Cc1c(C(=O)O)c(O)cc2c1C(=O)c1c(O)cc(O)cc1C2=O- InChIKey
DDTNCHWMNZLWKO-UHFFFAOYSA-N- Molecular formula
- C16H10O7
- Average molar mass
- 314.25 g/mol
- Monoisotopic mass
- 314.04265265
Overview
Laccaic acid D is a trihydroxyanthraquinone that is that is 3,6,8-trihydroxy-9,10-anthraquinone substituted by methyl and carboxy groups at positions 1 and 2 respectively. A minor component of LAC dye together with laccaic acids A, B and C. It has a role as a dye and an animal metabolite. It is a monocarboxylic acid, a polyphenol and a trihydroxyanthraquinone. It is a conjugate acid of a laccaic acid D(1-).
Names & identifiers
- Preferred name
- Laccaic acid D
- IUPAC
- 3,6,8-trihydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid
- English name
- laccaic acid D
- Molecular formula
- C16H10O7
- Molecular weight
- 314.25
Names & synonyms
Laccaic acid DFlavokermesic acidXanthokermesic acid3,6,8-trihydroxy-1-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acidCHEBI:901949,10-Dihydro-3,6,8-trihydroxy-1-methyl-9,10-dioxo-2-anthracenecarboxylic acid9,10-Dihydro-3,6,8-trihydroxy-1-methyl-9,10-dioxo-2-anthracenecarboxylic acid, 9CIXanthokermesateLaccaate DRefChem:1520163,6,8-trihydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid9,10-Dihydro-3,6,8-trihydroxy-1-methyl-9,10-dioxo-2-anthracenecarboxylate
Show more names
9,10-Dihydro-9,10-dioxo-1-methyl-3,6,8-trihydroxyanthracene-2-carboxylic acid3,6,8-Trihydroxy-1-methyl-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylic acid2-Anthracenecarboxylic acid, 9,10-dihydro-3,6,8-trihydroxy-1-methyl-9,10-dioxo-
18499-84-8CDN8KVA7ZFFlavokermes AcidDISCONTINUEDorb3024176SCHEMBL2138871CHEMBL5408347SCHEMBL29356605DTXSID501316089
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 545
Chemistry & industry
Pharmacology
Cellular LocationsCytoplasm
Applications
UsesFlavokermes Acid is an anthroquinone and natural yellow dye which may also display significant inhibition of lipid peroxidation.
Suppliers5 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
Additional notes
DefinitionChEBI: Laccaic acid D is a trihydroxyanthraquinone that is that is 3,6,8-trihydroxy-9,10-anthraquinone substituted by methyl and carboxy groups at positions 1 and 2 respectively. A minor component of LAC dye together with laccaic acids A, B and C. It has a role as a dye and an animal metabolite. It is a monocarboxylic acid, a polyphenol and a trihydroxyanthraquinone. It is a conjugate acid of a laccaic acid D(1-).
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…