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Basic information
- CAS
5487-00-3- Standard SMILES
CC1OC(OC2C(N)CC(N)C(OC3OC(CN)C(O)C(O)C3O)C2O)C(O)C(N)C1O- InChIKey
CFOGIGZVKWLSHG-UHFFFAOYSA-N- Molecular formula
- C18H36N4O10
- Average molar mass
- 468.5 g/mol
- Monoisotopic mass
- 468.24314336
Names & identifiers
- Preferred name
- Kanamycin, deoxy-
- IUPAC
- 2-(aminomethyl)-6-[4,6-diamino-3-(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-2-hydroxycyclohexyl]oxyoxane-3,4,5-triol
Names & synonyms
DeoxykanamycinKanamycin, deoxy-BRN 13331865487-00-3D-Streptamine, O-6-amino-6-deoxy-alpha-D-glucopyranosyl-(1-4)-O-(3-amino-3,6-dideoxy-alpha-D-glucopyranosyl-(1-6))-2-deoxy-RefChem:350352Kanamycin, deoxy-(7CI)SCHEMBL30471707DTXSID509702044,6-Diamino-3-[(6-amino-6-deoxyhexopyranosyl)oxy]-2-hydroxycyclohexyl 3-amino-3,6-dideoxyhexopyranoside
Database identifiers
- CAS
5487-00-3- PubChem CID
- 200009
- DTXSID
DTXSID50970204
Properties
Computed structural propertiesFilling in
- XLogP
- -6.4
- Topological polar surface area
- 262 Ų
- Hydrogen bond donors
- 10
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 622
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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