Basic information
- CAS
141869-53-6- Standard SMILES
Cc1cc2c(c(O)c1C(=O)O)-c1c(O)c3c(c(O)c1C[C@H]2O)C(=O)c1c(O)cc(O)cc1C3=O- InChIKey
QJLPWVUZFKETMK-LLVKDONJSA-N- Molecular formula
- C24H16O10
- Average molar mass
- 464.4 g/mol
- Monoisotopic mass
- 464.0743467
Overview
Pradimicin Q is a quinone and a member of tetracenes.
Names & identifiers
- Preferred name
- Pradimicin Q
- IUPAC
- (5R)-1,5,7,9,11,14-hexahydroxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carboxylic acid
- English name
- Pradimicin Q
- Molecular formula
- C24H16O10
- Molecular weight
- 464.38
Names & synonyms
Pradimicin Q141869-53-6(5R)-1,5,7,9,11,14-hexahydroxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carboxylic acidBenzo(a)naphthacene-2-carboxylic acid, 5,6,8,13-tetrahydro-1,5,7,9,11,14-hexahydroxy-3-methyl-8,13-dioxo-(5R)-1,5,7,9,11,14-hexahydroxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo(a)tetracene-2-carboxylic acidBenzo[a]naphthacene-2-carboxylic acid, 5,6,8,13-tetrahydro-1,5,7,9,11,14-hexahydroxy-3-methyl-8,13-dioxo-RefChem:175700(5r)-1,5,7,9,11,14-hexahydroxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracene-2-carboxylic acidSCHEMBL29361314DTXSID20931226CHEBI:2211381,5,7,9,11,14-Hexahydroxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracene-2-carboxylic acid
Show more names
Benzo(alpha)naphthacene-2-carboxylic acid, 5,6,8,13-tetrahydro-1,5,7,9,11,14-hexahydroxy-3-methyl-8,13-dioxo-
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 193 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 1
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 876
Physicochemical properties
- Boiling point
- 885.2 · 885.2±65.0 °C(Predicted)
- Density
- 1.83 · 1.830±0.06 g/cm3(Predicted)
- pka
- 2.56 · 2.56±0.40(Predicted)
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationCompounds that inhibit or block the activity of GLYCOSIDE HYDROLASES such as ALPHA-AMYLASES and ALPHA-GLUCOSIDASES.
Suppliers2 total
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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