Leucomycin V, 3-propanoate
Basic information
- CAS
35906-56-0- Standard SMILES
CCC(=O)O[C@@H]1CC(=O)O[C@H](C)C/C=C/C=C/[C@H](O)[C@H](C)C[C@H](CC=O)[C@H](O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](O)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@H]1OC- InChIKey
GNXVPSYTTPBCTM-RQWHEHCQSA-N- Molecular formula
- C38H63NO14
- Average molar mass
- 757.9 g/mol
- Monoisotopic mass
- 757.42485568
Names & identifiers
- Preferred name
- Leucomycin V, 3-propanoate
- IUPAC
- [(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-[(2S,3R,4R,5S,6R)-5-[(2S,4R,5S,6S)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-4-yl] propanoate
Names & synonyms
Leucomycin V, 3-propanoateRefChem:1088430Antibiotic SF 837M1SF 837M14''-Depropionylmidecamycin35906-56-0BRN 1338915
Database identifiers
- CAS
35906-56-0- PubChem CID
- 6445458
- DTXSID
DTXSID401318082
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 200 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 11
- Heavy atoms
- 53
- Formal charge
- 0
- Complexity
- 1,230
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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