Basic information
- CAS
56267-12-0- Standard SMILES
NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1.O.O=C(O)[C@H](O)[C@@H](O)C(=O)O- InChIKey
IMEQDWQCFHIYJB-LOMBACLASA-N- Molecular formula
- C20H30N6O11
- Average molar mass
- 530.5 g/mol
- Monoisotopic mass
- 530.19725579
Names & identifiers
- Preferred name
- Protirelin tartrate monohydrate
- IUPAC
- (2S)-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide;(2R,3R)-2,3-dihydroxybutanedioic acid;hydrate
Names & synonyms
Protirelin tartrate monohydrateProtirelin tartrate hydrateProtirelin tartrate hydrate [JAN]56267-12-0UNII-1N3H4TJE791N3H4TJE79L-Prolinamide, 5-oxo-L-prolyl-L-histidyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1), monohydrateL-Prolinamide, 5-oxo-L-prolyl-L-histidyl-, (R-(R*,R*))-2,3-dihydroxybutanedioate (1:1), monohydrateHirtonin (TN)DTXSID20204821Protirelin tartrate hydrate (JP18)(2S)-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide;(2R,3R)-2,3-dihydroxybutanedioic acid;hydrate
Show more names
D02007PROTIRELIN TARTRATE MONOHYDRATE [WHO-DD]Q27252635(2R,3R)-2,3-Dihydroxybutanedioic acid--5-oxo-L-prolyl-L-histidyl-L-prolinamide--water (1/1/1)
Database identifiers
- CAS
56267-12-0- PubChem CID
Properties
Computed structural properties
- Topological polar surface area
- 266 Ų
- Hydrogen bond donors
- 9
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 731
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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