3β-[(6-Deoxy-β-D-gulopyranosyl)oxy]-5,12β,14-trihydroxy-19-oxo-5β-card-20(22)-enolide (CAS 23605-05-2) — formula C29H42O11, molecular weight 566.6; category organic chemicals.
| CAS Number | 23605-05-2 |
|---|---|
| Molecular Formula | C29H42O11 |
| Molecular Weight | 566.6 |
| LogP | -1.8 |
| Category | Organic Chemicals |
3β-[(6-Deoxy-β-D-gulopyranosyl)oxy]-5,12β,14-trihydroxy-19-oxo-5β-card-20(22)-enolide is a carbon-based organic compound with CAS registry number 23605-05-2 and molecular formula C29H42O11 (molecular weight 566.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 23605-05-2
Its molecular formula C29H42O11 comprises 29 C, 42 H, 11 O atoms.
Also known as: 3β-[(6-Deoxy-β-D-gulopyranosyl)oxy]-5,12β,14-trihydroxy-19-oxo-5β-card-20(22)-enolide · 3β-[(6-脱氧-β-D-吡喃糖基)氧基]-5,12β,14-三羟基-19-氧代-5β-卡-20(22)-烯内酯
Category: organic chemicals
The CAS registry number of 3β-[(6-Deoxy-β-D-gulopyranosyl)oxy]-5,12β,14-trihydroxy-19-oxo-5β-card-20(22)-enolide is 23605-05-2.
Molecular formula C29H42O11, molecular weight 566.6.
It is also registered under: 3β-[(6-Deoxy-β-D-gulopyranosyl)oxy]-5,12β,14-trihydroxy-19-oxo-5β-card-20(22)-enolide, 3β-[(6-脱氧-β-D-吡喃糖基)氧基]-5,12β,14-三羟基-19-氧代-5β-卡-20(22)-烯内酯.
Category: Organic Chemicals.
Independent reference data for 3β-[(6-Deoxy-β-D-gulopyranosyl)oxy]-5,12β,14-trihydroxy-19-oxo-5β-card-20(22)-enolide (CAS 23605-05-2), compiled from public chemistry databases.
| CAS 号 | 23605-05-2 |
|---|---|
| PubChem CID | 441842 |
| 分子式 | C29H42O11 |
| IUPAC 名称 | (3S,5S,8R,9S,10S,12R,13S,14S,17R)-5,12,14-trihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde |
| UNII（FDA） | VPM8C16434 |
| Molecular Weight | 566.6 |
|---|---|
| XLogP3 | -1.8 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 4 |
| Exact Mass | 566.27271215 |
| Monoisotopic Mass | 566.27271215 |
| Topological Polar Surface Area | 183 |
| Heavy Atom Count | 40 |
alpha-Antiarin; 23605-05-2; .alpha.-Antiarin; UNII-VPM8C16434; Antiarigenin + D-gulomethylose; VPM8C16434; Antiarigenin + D-gulomethylose [German]; .ALPHA.-ANTIARIN [MI]; 3-((6-Deoxy-beta-D-glucopyranosyl)oxy)-5,12,14-trihydroxy-19-oxocard-20(22)-enolide; RefChem:111093; CARD-20(22)-ENOLIDE, 3-((6-DEOXY-BETA-D-GULOPYRANOSYL)OXY)-5,12,14-TRIHYDROXY-19-OXO-, (3BETA,5BETA,12BETA)-; Antiarin; Antiarigenin 3-O-beta-D-antiaroside; C08847; SCHEMBL5085035; CHEMBL4441597
3β-[(6-脱氧-β-D-吡喃糖基)氧基]-5,12β,14-三羟基-19-氧代-5β-卡-20(22)-烯内酯 · CAS 23605-05-2 · C29H42O11. UNII VPM8C16434.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3β-[(6-脱氧-β-D-吡喃糖基)氧基]-5,12β,14-三羟基-19-氧代-5β-卡-20(22)-烯内酯