6-Amino-1-formyl-5-hydroxy-1,3-cyclohexadiene
Basic information
- CAS
60046-57-3- Standard SMILES
N[C@H]1C(C=O)=CC=C[C@@H]1O- InChIKey
CAMXQXZPGMWBPD-BQBZGAKWSA-N- Molecular formula
- C7H9NO2
- Average molar mass
- 139.15 g/mol
- Monoisotopic mass
- 139.06332853
Overview
6-Amino-1-formyl-5-hydroxy-1,3-cyclohexadiene has been reported in Streptomyces with data available.
Names & identifiers
- Preferred name
- 6-Amino-1-formyl-5-hydroxy-1,3-cyclohexadiene
- IUPAC
- (5S,6S)-6-amino-5-hydroxycyclohexa-1,3-diene-1-carbaldehyde
- English name
- (5S,6S)-6-Amino-5-hydroxy-1,3-cyclohexadiene-1-carbaldehyde
- Molecular weight
- 0
Names & synonyms
60046-57-36-Amino-1-formyl-5-hydroxy-1,3-cyclohexadiene(5S,6S)-6-amino-5-hydroxycyclohexa-1,3-diene-1-carbaldehydeDTXSID902087751,3-Cyclohexadiene-1-carboxaldehyde, 6-amino-5-hydroxy-, (5S-trans)-P 3355RefChem:104165DTXCID40131266(5S,6S)-6-Amino-1-formyl-5-hydroxyl-1,3-cyclohexadieneAntibiotic P 3355BRN 2962460(5S-E)-6-Amino-5-hydroxy-1,3-cyclohexadiene-1-carboxaldehyde
Show more names
P-3355Antibiotic P-3355
(5S,6s)-6-amino-5-hydroxy-1,3-cyclohexadiene-1-carbaldehyde1,3-CYCLOHEXADIENE-1-CARBOXALDEHYDE, 6-AMINO-5-HYDROXY-, (5S-E)-DB-290028(5S,6S)-6-amino-5-hydroxy-cyclohexa-1,3-diene-1-carbaldehyde
Database identifiers
- CAS
60046-57-3- PubChem CID
- 43186
- DTXSID
DTXSID90208775- Nikkaji
- J18.423C
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 196
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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