3β-[[2-O-β-D-Glucopyranosyl-4-O-β-D-glucopyranosyl-β-D-glucopyranosyl]oxy]olean-12-en-28-oic acid (CAS 50657-29-9) — formula C48H78O18, molecular weight 943.1; category organic chemicals.
| CAS Number | 50657-29-9 |
|---|---|
| Molecular Formula | C48H78O18 |
| Molecular Weight | 943.1 |
| LogP | 2.2 |
| Category | Organic Chemicals |
3β-[[2-O-β-D-Glucopyranosyl-4-O-β-D-glucopyranosyl-β-D-glucopyranosyl]oxy]olean-12-en-28-oic acid is a carbon-based organic compound with CAS registry number 50657-29-9 and molecular formula C48H78O18 (molecular weight 943.1), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 50657-29-9
Its molecular formula C48H78O18 comprises 48 C, 78 H, 18 O atoms.
Also known as: 3β-[[2-O-β-D-Glucopyranosyl-4-O-β-D-glucopyranosyl-β-D-glucopyranosyl]oxy]olean-12-en-28-oic acid · 化合物 Oleanoglycotoxin A
Category: organic chemicals
The CAS registry number of 3β-[[2-O-β-D-Glucopyranosyl-4-O-β-D-glucopyranosyl-β-D-glucopyranosyl]oxy]olean-12-en-28-oic acid is 50657-29-9.
Molecular formula C48H78O18, molecular weight 943.1.
It is also registered under: 3β-[[2-O-β-D-Glucopyranosyl-4-O-β-D-glucopyranosyl-β-D-glucopyranosyl]oxy]olean-12-en-28-oic acid, 化合物 Oleanoglycotoxin A.
Category: Organic Chemicals.
Independent reference data for 3β-[[2-O-β-D-Glucopyranosyl-4-O-β-D-glucopyranosyl-β-D-glucopyranosyl]oxy]olean-12-en-28-oic acid (CAS 50657-29-9), compiled from public chemistry databases.
| CAS 号 | 50657-29-9 |
|---|---|
| PubChem CID | 170885 |
| 分子式 | C48H78O18 |
| IUPAC 名称 | (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-4-hydroxy-6-(hydroxymethyl)-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
| UNII（FDA） | 9BJL8C4JWR |
| Molecular Weight | 943.1 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 11 |
| Hydrogen Bond Acceptor Count | 18 |
| Rotatable Bond Count | 10 |
| Exact Mass | 942.51881563 |
| Monoisotopic Mass | 942.51881563 |
| Topological Polar Surface Area | 295 |
| Heavy Atom Count | 66 |
Oleanoglycotoxin-A; Oleanoglycotoxin A; 50657-29-9; C08963; 9BJL8C4JWR; CHEBI:7739; DTXSID201106229; Q27107574
化合物 Oleanoglycotoxin A · CAS 50657-29-9 · C48H78O18. UNII 9BJL8C4JWR.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 化合物 Oleanoglycotoxin A