1,3,10,11,12-Pentahydroxy-6-methyltetracene-2-carboxamide
Basic information
- CAS
2602-31-5- Standard SMILES
Cc1c2cccc(O)c2c(O)c2c(O)c3c(O)c(C(N)=O)c(O)cc3cc12- InChIKey
WBDQDVXPSGTJAV-UHFFFAOYSA-N- Molecular formula
- C20H15NO6
- Average molar mass
- 365.3 g/mol
- Monoisotopic mass
- 365.0899372
Overview
6-methylpretetramide is a member of the class of pretetramides in which the only additional substituent is a methyl group at position 6. It has a role as a bacterial metabolite. It is functionally related to a Pretetramid. It is a conjugate acid of a 6-methylpretetramide(1-).
Names & identifiers
- Preferred name
- 1,3,10,11,12-Pentahydroxy-6-methyltetracene-2-carboxamide
- IUPAC
- 1,3,10,11,12-pentahydroxy-6-methyltetracene-2-carboxamide
Names & synonyms
6-Methylpretetramide1,3,10,11,12-pentahydroxy-6-methyltetracene-2-carboxamide2602-31-5C06629AC1L9AK5CTK0J36196-methylpretetramidCHEBI:27879DTXSID403315622-Naphthacenecarboxamide, 1,3,10,11,12-pentahydroxy-6-methyl-1,3,10,11,12-pentahydroxy-6-methyl-tetracene-2-carboxamide
Database identifiers
- CAS
2602-31-5- PubChem CID
- 441107
- DTXSID
DTXSID40331562- ChEBI
CHEBI:27879- Nikkaji
- J2.622.010F
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 587
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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