(2S)-6-amino-2-[[(2S)-5-amino-2-[[(2S)-2,6-diaminohexanoyl]amino]pentanoyl]amino]hexanoic Acid
Basic information
- CAS
12270-00-7- Standard SMILES
NCCCC[C@H](NC(=O)[C@H](CCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O- InChIKey
NJSJHOJKUBVXDA-IHRRRGAJSA-N- Molecular formula
- C17H36N6O4
- Average molar mass
- 388.5 g/mol
- Monoisotopic mass
- 388.27980365
Names & identifiers
- Preferred name
- (2S)-6-amino-2-[[(2S)-5-amino-2-[[(2S)-2,6-diaminohexanoyl]amino]pentanoyl]amino]hexanoic Acid
- IUPAC
- (2S)-6-amino-2-[[(2S)-5-amino-2-[[(2S)-2,6-diaminohexanoyl]amino]pentanoyl]amino]hexanoic acid
- English name
- ACID RED 227
- Molecular weight
- 0
Names & synonyms
12270-00-7(2S)-6-amino-2-[[(2S)-5-amino-2-[[(2S)-2,6-diaminohexanoyl]amino]pentanoyl]amino]hexanoic AcidAcid red 227NJSJHOJKUBVXDA-IHRRRGAJSA-N1b2h12270-01-812270-08-5SCHEMBL30772342C.I. Acid red 227
Database identifiers
- CAS
12270-00-7、12270-01-8、12270-08-5- PubChem CID
- 444433
- EC Number
- 602-824-1、602-825-7、602-832-5
Properties
Computed structural properties
- XLogP
- -6
- Topological polar surface area
- 200 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 16
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 449
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information
Chemical: C.I. Acid Red 227
Chemical: C.I. Acid Red 228
C.I. Acid Red 227: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…