A 63075
Basic information
- CAS
115129-30-1- Standard SMILES
CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(OC(N)=O)C(C)O2)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OC)CC(C)C(=O)C(C)C(O)C1(C)O- InChIKey
NAICHCWALKXCFL-UHFFFAOYSA-N- Molecular formula
- C39H70N2O14
- Average molar mass
- 791 g/mol
- Monoisotopic mass
- 790.48270491
Names & identifiers
- Preferred name
- A 63075
- IUPAC
- [6-[[6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-12,13-dihydroxy-7-methoxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-4-yl]oxy]-4-methoxy-2,4-dimethyloxan-3-yl] carbamate
Names & synonyms
115129-30-1A 63075A-63075Erythromycin, 6-O-methyl-, 4''-carbamateRefChem:108313[6-[[6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-12,13-dihydroxy-7-methoxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-4-yl]oxy]-4-methoxy-2,4-dimethyloxan-3-yl] carbamate6-O-Methylerythromycin 4''-carbamate6-O-Methyl-4''-O-(aminocarbonyl)erythromycin A
Database identifiers
- CAS
115129-30-1- PubChem CID
- 84022
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 215 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 10
- Heavy atoms
- 55
- Formal charge
- 0
- Complexity
- 1,310
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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