3β-[(3-O-Methyl-2,6-dideoxy-β-D-lyxo-hexopyranosyl)oxy]-14-hydroxy-5β,14β-carda-20(22)-enolide (CAS 12738-19-1) — formula C30H46O7, molecular weight 518.7; category organic chemicals.
| CAS Number | 12738-19-1 |
|---|---|
| Molecular Formula | C30H46O7 |
| Molecular Weight | 518.7 |
| LogP | 3 |
| Category | Organic Chemicals |
3β-[(3-O-Methyl-2,6-dideoxy-β-D-lyxo-hexopyranosyl)oxy]-14-hydroxy-5β,14β-carda-20(22)-enolide is a carbon-based organic compound with CAS registry number 12738-19-1 and molecular formula C30H46O7 (molecular weight 518.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 12738-19-1
Its molecular formula C30H46O7 comprises 30 C, 46 H, 7 O atoms.
Also known as: 3β-[(3-O-Methyl-2,6-dideoxy-β-D-lyxo-hexopyranosyl)oxy]-14-hydroxy-5β,14β-carda-20(22)-enolide · 夹竹桃苷A
Category: organic chemicals
The CAS registry number of 3β-[(3-O-Methyl-2,6-dideoxy-β-D-lyxo-hexopyranosyl)oxy]-14-hydroxy-5β,14β-carda-20(22)-enolide is 12738-19-1.
Molecular formula C30H46O7, molecular weight 518.7.
It is also registered under: 3β-[(3-O-Methyl-2,6-dideoxy-β-D-lyxo-hexopyranosyl)oxy]-14-hydroxy-5β,14β-carda-20(22)-enolide, 夹竹桃苷A.
Category: Organic Chemicals.
Independent reference data for 3β-[(3-O-Methyl-2,6-dideoxy-β-D-lyxo-hexopyranosyl)oxy]-14-hydroxy-5β,14β-carda-20(22)-enolide (CAS 12738-19-1), compiled from public chemistry databases.
| CAS 号 | 12738-19-1 |
|---|---|
| PubChem CID | 44425145 |
| 分子式 | C30H46O7 |
| IUPAC 名称 | 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-14-hydroxy-3-[(2R,4R,5S,6R)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one |
| UNII（FDA） | NS00093817 |
| Molecular Weight | 518.7 |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 518.32435380 |
| Monoisotopic Mass | 518.32435380 |
| Topological Polar Surface Area | 94.5 |
| Heavy Atom Count | 37 |
Odoroside A; 12738-19-1; DTXSID801319113; RefChem:1093841; DTXCID801748069; CHEMBL229259; 3beta-[(3-O-Methyl-2,6-dideoxy-beta-D-lyxo-hexopyranosyl)oxy]-14-hydroxy-5beta,14beta-carda-20(22)-enolide; Odorosid A; Odorosid A [German]; orb1981777; SCHEMBL31121792; HY-N7496; BDBM50465466; DA-66309; MS-29622; CS-0131098
夹竹桃苷A · CAS 12738-19-1 · C30H46O7. UNII NS00093817.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 夹竹桃苷A