alpha-D-Glucopyranoside, methyl 3-deoxy-3-[[(methylnitrosoamino)carbonyl]amino]-
Basic information
- CAS
52019-10-0- Standard SMILES
COC1OC(CO)C(O)C(NC(=O)N(C)N=O)C1O- InChIKey
ITMFEGUZHKHAGY-UHFFFAOYSA-N- Molecular formula
- C9H17N3O7
- Average molar mass
- 279.25 g/mol
- Monoisotopic mass
- 279.10664989
Names & identifiers
- Preferred name
- alpha-D-Glucopyranoside, methyl 3-deoxy-3-[[(methylnitrosoamino)carbonyl]amino]-
- IUPAC
- 3-[3,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-4-yl]-1-methyl-1-nitrosourea
Names & synonyms
52019-12-2NSC156273Altropyranoside, .alpha.-D-CHEMBL196956552019-10-0NSC160466NSC-156273NSC-160466.alpha.-D-Glucopyranoside, methyl 3-deoxy-3-[[(methylnitrosoamino)carbonyl]amino]-NCI60_001194
Database identifiers
- CAS
52019-10-0、52019-12-2- PubChem CID
- 291285
- DTXSID
DTXSID10303054- ChEMBL
CHEMBL1969565
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 329
Experimental & physicochemical properties
LogP-1.45
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Related reactions
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Compound notes
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