L-Altritol, 1,2,5,6-tetradeoxy-1,6-diphenyl-2,5-bis((2-(((2-pyridinylmethoxy)carbonyl)amino)benzoyl)amino)-
Basic information
- CAS
173094-26-3- Standard SMILES
O=C(Nc1ccccc1C(=O)N[C@@H](Cc1ccccc1)[C@H](O)[C@H](O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1NC(=O)OCc1ccccn1)OCc1ccccn1- InChIKey
SAIHLPVEVOOIMK-QSJDGAHRSA-N- Molecular formula
- C46H44N6O8
- Average molar mass
- 808.9 g/mol
- Monoisotopic mass
- 808.32206238
Names & identifiers
- Preferred name
- L-Altritol, 1,2,5,6-tetradeoxy-1,6-diphenyl-2,5-bis((2-(((2-pyridinylmethoxy)carbonyl)amino)benzoyl)amino)-
- IUPAC
- pyridin-2-ylmethyl N-[2-[[(2S,3R,4S,5S)-3,4-dihydroxy-1,6-diphenyl-5-[[2-(pyridin-2-ylmethoxycarbonylamino)benzoyl]amino]hexan-2-yl]carbamoyl]phenyl]carbamate
Names & synonyms
173094-26-3CHEMBL408110L-Altritol, 1,2,5,6-tetradeoxy-1,6-diphenyl-2,5-bis((2-(((2-pyridinylmethoxy)carbonyl)amino)benzoyl)amino)-N-((1S,2S,4S,3R)-2,3-dihydroxy-5-phenyl-1-benzyl-4-((2-((2-pyridylmethoxy)carbonylamino)phenyl)carbonylamino)pentyl)(2-((2-pyridylmethoxy)carbonylamino)phenyl)carboxamideL-Altritol, 1,2,5,6-tetradeoxy-1,6-diphenyl-2,5-bis[[2-[[(2-pyridinylmethoxy)carbonyl]amino]benzoyl]amino]-N-[(1S,2S,4S,3R)-2,3-dihydroxy-5-phenyl-1-benzyl-4-({2-[(2-pyridylmethoxy)carbonylamino]phenyl}carbonylamino)pentyl]{2-[(2-pyridylmethoxy)carbonylamino]phenyl}carboxamideDTXSID00169520BDBM500732541,2,5,6-Tetradeoxy-1,6-diphenyl-2,5-bis[2-({[(pyridin-2-yl)methoxy]carbonyl}amino)benzamido]-L-altritol2-pyridylmethyl N-[2-[[(1S,2S,3R,4S)-1-benzyl-2,3-dihydroxy-5-phenyl-4-[[2-(2-pyridylmethoxycarbonylamino)benzoyl]amino]pentyl]carbamoyl]phenyl]carbamate
Database identifiers
- CAS
173094-26-3- PubChem CID
- 468435
- DTXSID
DTXSID00169520- ChEMBL
CHEMBL408110
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 201 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 19
- Heavy atoms
- 60
- Formal charge
- 0
- Complexity
- 1,230
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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