Nsc-114460
Basic information
- CAS
78308-46-0- Standard SMILES
CO[C@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1N(C(C)=O)C(=O)N(CCCl)N=O- InChIKey
JQACZRYIRCGBEX-HHARLNAUSA-N- Molecular formula
- C18H26ClN3O11
- Average molar mass
- 495.9 g/mol
- Monoisotopic mass
- 495.1255863
Names & identifiers
- Preferred name
- Nsc-114460
- IUPAC
- [(2R,3S,4R,5R,6S)-5-[acetyl-[2-chloroethyl(nitroso)carbamoyl]amino]-3,4-diacetyloxy-6-methoxyoxan-2-yl]methyl acetate
Names & synonyms
78308-46-0NSC 114460alpha-D-Glucopyranoside, methyl 2-(acetyl(((2-chloroethyl)nitrosoamino)carbonyl)amino)-2-deoxy-, 3,4,6-triacetateRefChem:927970Nsc-1144603-(Methyl-alpha-D-glucopyranos-2-yl)-1-(2-chloroethyl)-1-nitrosourea[(2R,3S,4R,5R,6S)-5-[acetyl-[2-chloroethyl(nitroso)carbamoyl]amino]-3,4-diacetyloxy-6-methoxyoxan-2-yl]methyl acetateDTXSID60999663Methyl 3,4,6-tri-O-acetyl-2-{acetyl[(2-chloroethyl)(nitroso)carbamoyl]amino}-2-deoxyhexopyranosideMethyl 3,4,6-tri-O-acetyl-2-{N-[(2-chloroethyl)(nitroso)carbamoyl]acetamido}-2-deoxy-alpha-D-glucopyranoside
Database identifiers
- CAS
78308-46-0- PubChem CID
- 192140
- DTXSID
DTXSID60999663
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 167 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 11
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 765
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…