isoliquiritin (CAS 5041-81-6) — formula C21H22O9, molecular weight 418.4; category organic chemicals.
| CAS Number | 5041-81-6 |
|---|---|
| Molecular Formula | C21H22O9 |
| Molecular Weight | 418.4 |
| LogP | 1.7 |
| Category | Organic Chemicals |
isoliquiritin is a carbon-based organic compound with CAS registry number 5041-81-6 and molecular formula C21H22O9 (molecular weight 418.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5041-81-6
Its molecular formula C21H22O9 comprises 21 C, 22 H, 9 O atoms.
Also known as: isoliquiritin · 异甘草甙
Category: organic chemicals
The CAS registry number of isoliquiritin is 5041-81-6.
Molecular formula C21H22O9, molecular weight 418.4.
It is also registered under: isoliquiritin, 异甘草甙.
Category: Organic Chemicals.
Independent reference data for isoliquiritin (CAS 5041-81-6), compiled from public chemistry databases.
| CAS Registry Number | 5041-81-6 |
|---|---|
| PubChem CID | 5318591 |
| Molecular formula | C21H22O9 |
| IUPAC name | (E)-1-(2,4-dihydroxyphenyl)-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one |
| UNII (FDA) | 2Y348H1V4W |
| Molecular Weight | 418.4 |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 6 |
| Exact Mass | 418.12638228 |
| Monoisotopic Mass | 418.12638228 |
| Topological Polar Surface Area | 157 |
| Heavy Atom Count | 30 |
Isoliquiritin; 5041-81-6; Isoliquiritoside; UNII-2Y348H1V4W; 4-[(1E)-3-(2,4-dihydroxyphenyl)-3-oxoprop-1-en-1-yl]phenyl beta-D-glucopyranoside; CHEBI:80839; 4-beta-D-glucopyranosyloxy-2',4'-dihydroxy-trans-chalcone; 2-Propen-1-one, 1-(2,4-dihydroxyphenyl)-3-(4-(beta-D-glucopyranosyloxy)phenyl)-, (2E)-; 4-((1E)-3-(2,4-dihydroxyphenyl)-3-oxoprop-1-en-1-yl)phenyl beta-D-glucopyranoside; RefChem:40293; 7014-39-3; MFCD00272145; 2Y348H1V4W; Neoisoliquiritigenin; Isoliquiriiin; Isoliquiritin?
isoliquiritin · CAS 5041-81-6 · C21H22O9. UNII 2Y348H1V4W.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 异甘草甙