6'''-Deamino-6'''-hydroxyparomomycin I
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Basic information
- CAS
78524-72-8- Standard SMILES
NC1CC(N)C(OC2OC(CO)C(O)C(O)C2N)C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3N)C2O)C1O- InChIKey
VCHIDEKSPVNIGR-UHFFFAOYSA-N- Molecular formula
- C23H44N4O15
- Average molar mass
- 616.6 g/mol
- Monoisotopic mass
- 616.28031671
Overview
structure given in first source
Names & identifiers
- Preferred name
- 6'''-Deamino-6'''-hydroxyparomomycin I
- IUPAC
- 5-amino-6-[4,6-diamino-2-[4-[3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxycyclohexyl]oxy-2-(hydroxymethyl)oxane-3,4-diol
- English name
- 6'''-deamino-6'''-hydroxyparomomycin I
- Molecular formula
- C23H44N4O15
- Molecular weight
- 616.61326
Names & synonyms
78524-72-86'''-Deamino-6'''-hydroxyparomomycin IDEHPIRefChem:1036076'''-Hydroxyparmomomycin5-amino-6-[4,6-diamino-2-[4-[3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxycyclohexyl]oxy-2-(hydroxymethyl)oxane-3,4-diolDTXSID60999820D-Streptamine, O-2-amino-2-deoxy-alpha-D-glucopyranosyl)-(1-4)-O-(O-2-amino-2-deoxy-beta-L-idopyranosyl-(1-3)-beta-D-ribofuranosyl-(1-5))-2-deoxy-, hydrate (2:3)D-Streptamine, O-2-amino-2-deoxy-alpha-D-glucopyranosyl-(1-4)-O-(O-2-amino-2-deoxy-beta-L-idopyranosyl-(1-3)-beta-D-ribofuranosyl-(1-5))-2-deoxy-, (R-(E))-4,6-diamino-2-{[3-O-(2-amino-2-deoxyhexopyranosyl)pentofuranosyl]oxy}-3-hydroxycyclohexyl 2-amino-2-deoxyhexopyranoside6'''-Deamino-6'''-hydroxyparomomycinD-Streptamine, O-2-amino-2-deoxy-α-D-glucopyranosyl-(1→4)-O-[O-2-amino-2-deoxy-β-L-idopyranosyl-(1→3)-β-D-ribofuranosyl-(1→5)]-2-deoxy- (9CI)
Database identifiers
- CAS
78524-72-8
Properties
Computed structural propertiesFilling in
- XLogP
- -8.5
- Topological polar surface area
- 342 Ų
- Hydrogen bond donors
- 13
- Hydrogen bond acceptors
- 19
- Rotatable bonds
- 9
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 869
Physicochemical properties
- Boiling point
- 953 · 953.0±65.0 °C(Predicted)
- Density
- 1.67 · 1.67±0.1 g/cm3(Predicted)
- pka
- 12.93 · 12.93±0.70(Predicted)
Chemistry & industry
Applications
Uses6"'-Deamino-6"'-hydroxyparomomycin I is an amino glycosyl antibiotic that can be produced by Streptomyces rimosus forma paromomycinus A67 15. It is active against both Gram-positive and Gram-negative bacteria. 6"'-Deamino-6"'-hydroxyparomomycin I can be used as an intermediate in the biosynthesis of paromomycin[1][2].
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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