Basic information
- CAS
73665-15-3- Standard SMILES
CC[C@H]1OC(=O)/C=C/[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@H](C)C[C@@H](C)C(=O)/C=C/[C@@H]2O[C@H]2[C@@H]1CO[C@@H]1O[C@H](C)[C@@H](O)[C@@H](OC)[C@H]1OC- InChIKey
QABCJBNUVVMWAL-XNABIBRNSA-N- Molecular formula
- C37H61NO12
- Average molar mass
- 711.9 g/mol
- Monoisotopic mass
- 711.41937638
Names & identifiers
- Preferred name
- (1S,2R,3R,6E,8S,9S,10S,12R,14E,16S)-9-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3-ethyl-2-[[(2R,3R,4R,5R,6R)-5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl]oxymethyl]-8,10,12-trimethyl-4,17-dioxabicyclo[14.1.0]heptadeca-6,14-diene-5,13-dione
- IUPAC
- (1S,2R,3R,6E,8S,9S,10S,12R,14E,16S)-9-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3-ethyl-2-[[(2R,3R,4R,5R,6R)-5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl]oxymethyl]-8,10,12-trimethyl-4,17-dioxabicyclo[14.1.0]heptadeca-6,14-diene-5,13-dione
- English name
- Antibiotic A 11725 I
- Molecular formula
- C37H61NO12
- Molecular weight
- 711.884
Names & synonyms
73665-15-3CS-0105743AR-5-1A-11725IMycinamicinMycinamicin ⅠMycinomycin IMycinamicin IAntibiotic AR-5-1Antibiotic A 11725 I
Database identifiers
- CAS
73665-15-3- PubChem CID
- 90657384
- DTXSID
DTXSID701101331
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 9
- Heavy atoms
- 50
- Formal charge
- 0
- Complexity
- 1,170
Physicochemical properties
- Melting point
- 105 °C · 105°C
- Boiling point
- 702.95 °C · 702.95°C (rough estimate)
- Density
- 1.1571 · 1.1571 (rough estimate)
- refractive index
- 1.663 · 1.6630 (estimate)
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Applications
UsesMycinamicin I is classified as a macrolide antibiotic.
Suppliers3 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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