de-(N-methyl)-8,9-anhydroerythromycin A 6,9-hemicetal (CAS 98641-05-5) — formula C36H63NO12, molecular weight 701.9; category organic chemicals.
| CAS Number | 98641-05-5 |
|---|---|
| Molecular Formula | C36H63NO12 |
| Molecular Weight | 701.9 |
| LogP | 1.9 |
| Category | Organic Chemicals |
de-(N-methyl)-8,9-anhydroerythromycin A 6,9-hemicetal is a carbon-based organic compound with CAS registry number 98641-05-5 and molecular formula C36H63NO12 (molecular weight 701.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 98641-05-5
Its molecular formula C36H63NO12 comprises 36 C, 63 H, 1 N, 12 O atoms.
Also known as: de-(N-methyl)-8,9-anhydroerythromycin A 6,9-hemicetal · 去-(N-甲基)-8,9-脱水红霉素A 6,9-半缩醛
Category: organic chemicals
The CAS registry number of de-(N-methyl)-8,9-anhydroerythromycin A 6,9-hemicetal is 98641-05-5.
Molecular formula C36H63NO12, molecular weight 701.9.
It is also registered under: de-(N-methyl)-8,9-anhydroerythromycin A 6,9-hemicetal, 去-(N-甲基)-8,9-脱水红霉素A 6,9-半缩醛.
Category: Organic Chemicals.
Independent reference data for de-(N-methyl)-8,9-anhydroerythromycin A 6,9-hemicetal (CAS 98641-05-5), compiled from public chemistry databases.
| CAS 号 | 98641-05-5 |
|---|---|
| PubChem CID | 84012 |
| 分子式 | C36H63NO12 |
| IUPAC 名称 | (2R,3R,4S,5R,8R,9S,10S,11R,12R)-5-ethyl-3,4-dihydroxy-9-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-11-[(2S,3R,4S,6R)-3-hydroxy-6-methyl-4-(methylamino)oxan-2-yl]oxy-2,4,8,10,12,14-hexamethyl-6,15-dioxabicyclo[10.2.1]pentadec-1(14)-en-7-one |
| Molecular Weight | 701.9 |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 13 |
| Rotatable Bond Count | 7 |
| Exact Mass | 701.43502644 |
| Monoisotopic Mass | 701.43502644 |
| Topological Polar Surface Area | 175 |
| Heavy Atom Count | 49 |
ME-34; De-(N-methyl)-8,9-anhydroerythromycin A 6,9-hemicetal; 98641-05-5; RefChem:131063; ME 34; CHEMBL432129; SCHEMBL29539675; 8,9-Didehydro-N-demethyl-9-deoxo-6-deoxy-6,9-epoxyerythromycin; Erythromycin, 8,9-didehydro-N-demethyl-9-deoxo-6-deoxy-6,9-epoxy-
去-(N-甲基)-8,9-脱水红霉素A 6,9-半缩醛 · CAS 98641-05-5 · C36H63NO12.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.