Benzo(a)naphthacene-8,13-dione, 5,6-dihydro-1,7,9,11-tetrahydroxy-3-methyl-
Basic information
- CAS
94129-85-8- Standard SMILES
Cc1cc(O)c2c(c1)CCc1c-2cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O- InChIKey
LWERGSAPTOUIHZ-UHFFFAOYSA-N- Molecular formula
- C23H16O6
- Average molar mass
- 388.4 g/mol
- Monoisotopic mass
- 388.09468823
Overview
structure given in first source; isolated from bacteria of the genus Frankia
Names & identifiers
- Preferred name
- Benzo(a)naphthacene-8,13-dione, 5,6-dihydro-1,7,9,11-tetrahydroxy-3-methyl-
- IUPAC
- 1,7,9,11-tetrahydroxy-3-methyl-5,6-dihydrobenzo[a]tetracene-8,13-dione
- English name
- antibiotic G 2N
- Molecular formula
- C23H16O6
- Molecular weight
- 388.36954
Names & synonyms
94129-85-8Benzo(a)naphthacene-8,13-dione, 5,6-dihydro-1,7,9,11-tetrahydroxy-3-methyl-RefChem:1181581,7,9,11-tetrahydroxy-3-methyl-5,6-dihydrobenzo[a]tetracene-8,13-dioneAntibiotic G 2NG-2NG 2NSCHEMBL17867040DTXSID80916397
Database identifiers
- CAS
94129-85-8- PubChem CID
- 146804
- DTXSID
DTXSID80916397- Nikkaji
- J731.330F
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 693
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Related reactions
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Compound notes
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