Yl 704 A1
Basic information
- CAS
40615-47-2- Standard SMILES
CCC(=O)OC1CC(=O)OC(C)C/C=C/C=C\C(O)C(C)CC(CC=O)C(OC2OC(C)C(OC3CC(C)(O)C(OC(=O)CC(C)C)C(C)O3)C(N(C)C)C2O)C1OC- InChIKey
MGVDOYIXWZRNIN-JREGAVMUSA-N- Molecular formula
- C43H71NO15
- Average molar mass
- 842 g/mol
- Monoisotopic mass
- 841.48237056
Overview
major component of macrolide antibiotic complex YL-704 isolated from Streptomyces platensis subsp. malvinus; structure
Names & identifiers
- Preferred name
- Yl 704 A1
- IUPAC
- [6-[4-(dimethylamino)-5-hydroxy-6-[[(11Z,13E)-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-4-propanoyloxy-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] 3-methylbutanoate
- English name
- Leucomycin V, 4B-(3-methylbutanoate) 3-propanoate
- Molecular formula
- C43H71NO15
- Molecular weight
- 842.03
Names & synonyms
40615-47-2Yl 704 A1Yl-704 A1Leucomycin V, 4(B)-(3-methylbutanoate) 3-propanoateRefChem:195655[6-[4-(dimethylamino)-5-hydroxy-6-[[(11Z,13E)-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-4-propanoyloxy-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] 3-methylbutanoateplatenomycin A1 9-propionateYl704 A1Platenomycin A1Platenomycin ImpurityJosamycin EP Impurity E (Platenomycin A1)Leucomycin V, 4B-(3-methylbutanoate) 3-propanoate
Show more names
Josamycin Impurity EQ: What is Josamycin Impurity E Q: What is the CAS Number of Josamycin Impurity E(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-[[3,6-Dideoxy-4-O-[2,6-dideoxy-3-C-methyl-4-O-(3-methylbutanoyl)-α-L-ribo-hexopyranosyl]-3-(dimethylamino)-β-D-glucopyranosyl]oxy]-10-hydroxy-5-methoxy-9,16-dimethyl-7-(2-oxoethyl)-4-(propanoyloxy)oxacyclohexadeca-11,13-dien-2-one
Database identifiers
- CAS
40615-47-2- PubChem CID
- 6443528
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 206 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 15
- Heavy atoms
- 59
- Formal charge
- 0
- Complexity
- 1,410
Physicochemical properties
- Boiling point
- 884.9 · 884.9±65.0 °C(Predicted)
- Density
- 1.2 · 1.20±0.1 g/cm3(Predicted)
- pka
- 13.06 · 13.06±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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