2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one (CAS 3761-64-6) — formula C22H26O8, molecular weight 418.4; category organic chemicals.
| CAS Number | 3761-64-6 |
|---|---|
| Molecular Formula | C22H26O8 |
| Molecular Weight | 418.4 |
| LogP | 3 |
| Category | Organic Chemicals |
2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one is a carbon-based organic compound with CAS registry number 3761-64-6 and molecular formula C22H26O8 (molecular weight 418.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 3761-64-6
Its molecular formula C22H26O8 comprises 22 C, 26 H, 8 O atoms.
Also known as: 2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one · 化合物 Acetylflavaspidic acid
Category: organic chemicals
The CAS registry number of 2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one is 3761-64-6.
Molecular formula C22H26O8, molecular weight 418.4.
It is also registered under: 2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one, 化合物 Acetylflavaspidic acid.
Category: Organic Chemicals.
Independent reference data for 2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one (CAS 3761-64-6), compiled from public chemistry databases.
| CAS 号 | 3761-64-6 |
|---|---|
| PubChem CID | 25096977 |
| 分子式 | C22H26O8 |
| IUPAC 名称 | 2-acetyl-4-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one |
| UNII（FDA） | 91GX3RYD91 |
| Molecular Weight | 418.4 |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 418.16276778 |
| Monoisotopic Mass | 418.16276778 |
| Topological Polar Surface Area | 152 |
| Heavy Atom Count | 30 |
RefChem:1092655; Npc122363; Flavaspidic acid AB; 3761-64-6; UNII-91GX3RYD91; 91GX3RYD91; Acetylflavaspidic acid; orb1991772; SCHEMBL16352047; SCHEMBL30212041; CHEBI:65897; AKOS032946008; T124934; Q27134389
化合物 Acetylflavaspidic acid · CAS 3761-64-6 · C22H26O8. UNII 91GX3RYD91.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.