Narasin, 20-deoxy-17-epi-
Completing data — refresh the page later to see the latest
Basic information
- CAS
70022-35-4- Standard SMILES
CCC(C(=O)O)C1OC(C(C)C(O)C(C)C(=O)C(CC)C2OC3(C=CCC4(CCC(C)(C5CCC(O)(CC)C(C)O5)O4)O3)C(C)CC2C)C(C)CC1C- InChIKey
DIUFDFNALWNSNW-UHFFFAOYSA-N- Molecular formula
- C43H72O10
- Average molar mass
- 749 g/mol
- Monoisotopic mass
- 748.5125485
Names & identifiers
- Preferred name
- Narasin, 20-deoxy-17-epi-
- IUPAC
- 2-[6-[6-[3-(5-ethyl-5-hydroxy-6-methyloxan-2-yl)-3,10,12-trimethyl-4,6,8-trioxadispiro[4.1.57.35]pentadec-13-en-9-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-3,5-dimethyloxan-2-yl]butanoic acid
- English name
- 20-Deoxy-17-epinararin
- Molecular formula
- C43H72O10
- Molecular weight
- 749.03
Names & synonyms
Narasin, 20-deoxy-17-epi-70051-99-9RefChem:109227820-DeoxynarasinDeoxy-epi-narasin70022-35-420-Deoxy-epi-17-narasinSallinomycin, 2-deoxy-4-methyl-, (4S,17R)-20-Deoxy-17-epinararinorb3023896DTXSID40990294DIUFDFNALWNSNW-UHFFFAOYSA-N
Show more names
20-Deoxy-17-epinarasin(4S)-4-Methyl-20-deoxysalinomycin(4S,17R)-4-Methyl-20-deoxysalinomycinSalinomycin, 20-deoxy-4-methyl-, (4S)- (9CI)
TN110252-(6-{6-[2-(5-Ethyl-5-hydroxy-6-methyloxan-2-yl)-2,10,12-trimethyl-1,6,8-trioxadispiro[4.1.5~7~.3~5~]pentadec-13-en-9-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl}-3,5-dimethyloxan-2-yl)butanoic acid
Database identifiers
- CAS
70022-35-4、70051-99-9- PubChem CID
- 3053530
- DTXSID
DTXSID40990294
Properties
Computed structural propertiesFilling in
- XLogP
- 7.3
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 12
- Heavy atoms
- 53
- Formal charge
- 0
- Complexity
- 1,320
Chemistry & industry
Pharmacology
Cellular LocationsExtracellular
Related reactions
3 records
Compound notes
Loading…