3β-[3-O-Methyl-4-O-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)-2,6-dideoxy-β-D-ribo-hexopyranosyloxy]-14-hydroxy-5β-cardanolide-20(22)-ene (CAS 9007-56-1) — formula C42H66O17, molecular weight 843.0; category organic chemicals.
| CAS Number | 9007-56-1 |
|---|---|
| Molecular Formula | C42H66O17 |
| Molecular Weight | 843.0 |
| LogP | -0.7 |
| Category | Organic Chemicals |
3β-[3-O-Methyl-4-O-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)-2,6-dideoxy-β-D-ribo-hexopyranosyloxy]-14-hydroxy-5β-cardanolide-20(22)-ene is a carbon-based organic compound with CAS registry number 9007-56-1 and molecular formula C42H66O17 (molecular weight 843.0), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 9007-56-1
Its molecular formula C42H66O17 comprises 42 C, 66 H, 17 O atoms.
Also known as: 3β-[3-O-Methyl-4-O-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)-2,6-dideoxy-β-D-ribo-hexopyranosyloxy]-14-hydroxy-5β-cardanolide-20(22)-ene · 3β-[3-O-甲基-4-O-(6-O-β-D-吡喃葡萄糖基-β-D-吡喃葡萄糖基)-2,6-二脱氧-β-D-核糖吡喃糖基氧基]-14-羟基-5β-腰果内酯-20(22)-烯
Category: organic chemicals
The CAS registry number of 3β-[3-O-Methyl-4-O-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)-2,6-dideoxy-β-D-ribo-hexopyranosyloxy]-14-hydroxy-5β-cardanolide-20(22)-ene is 9007-56-1.
Molecular formula C42H66O17, molecular weight 843.0.
It is also registered under: 3β-[3-O-Methyl-4-O-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)-2,6-dideoxy-β-D-ribo-hexopyranosyloxy]-14-hydroxy-5β-cardanolide-20(22)-ene, 3β-[3-O-甲基-4-O-(6-O-β-D-吡喃葡萄糖基-β-D-吡喃葡萄糖基)-2,6-二脱氧-β-D-核糖吡喃糖基氧基]-14-羟基-5β-腰果内酯-20(22)-烯.
Category: Organic Chemicals.
Independent reference data for 3β-[3-O-Methyl-4-O-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)-2,6-dideoxy-β-D-ribo-hexopyranosyloxy]-14-hydroxy-5β-cardanolide-20(22)-ene (CAS 9007-56-1), compiled from public chemistry databases.
| CAS 号 | 9007-56-1 |
|---|---|
| PubChem CID | 202243 |
| 分子式 | C42H66O17 |
| IUPAC 名称 | 3-[14-hydroxy-3-[4-methoxy-6-methyl-5-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-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 |
| Molecular Weight | 843.0 |
|---|---|
| XLogP3 | -0.7 |
| Hydrogen Bond Donor Count | 8 |
| Hydrogen Bond Acceptor Count | 17 |
| Rotatable Bond Count | 10 |
| Exact Mass | 842.43000063 |
| Monoisotopic Mass | 842.43000063 |
| Topological Polar Surface Area | 253 |
| Heavy Atom Count | 59 |
DTXSID101009133; RefChem:1066338; DTXCID601435959; Echugin; C42H66O17; JAA00756
3β-[3-O-甲基-4-O-(6-O-β-D-吡喃葡萄糖基-β-D-吡喃葡萄糖基)-2,6-二脱氧-β-D-核糖吡喃糖基氧基]-14-羟基-5β-腰果内酯-20(22)-烯 · CAS 9007-56-1 · C42H66O17.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3β-[3-O-甲基-4-O-(6-O-β-D-吡喃葡萄糖基-β-D-吡喃葡萄糖基)-2,6-二脱氧-β-D-核糖吡喃糖基氧基]-14-羟基-5β-腰果内酯-20(22)-烯