4-[2-[(1R)-8aα-Acetoxymethyl-3,4,4aβ,5,6,7,8,8a-octahydro-8α-hydroxy-5α,6α-dimethylspiro[naphthalene-1(2H),2'-oxiran]-5-yl]ethyl]furan-2(5H)-one (CAS 62640-06-6) — formula C22H32O6, molecular weight 392.5; category organic chemicals.
| CAS Number | 62640-06-6 |
|---|---|
| Molecular Formula | C22H32O6 |
| Molecular Weight | 392.5 |
| LogP | 2.3 |
| Category | Organic Chemicals |
4-[2-[(1R)-8aα-Acetoxymethyl-3,4,4aβ,5,6,7,8,8a-octahydro-8α-hydroxy-5α,6α-dimethylspiro[naphthalene-1(2H),2'-oxiran]-5-yl]ethyl]furan-2(5H)-one is a carbon-based organic compound with CAS registry number 62640-06-6 and molecular formula C22H32O6 (molecular weight 392.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 62640-06-6
Its molecular formula C22H32O6 comprises 22 C, 32 H, 6 O atoms.
Also known as: 4-[2-[(1R)-8aα-Acetoxymethyl-3,4,4aβ,5,6,7,8,8a-octahydro-8α-hydroxy-5α,6α-dimethylspiro[naphthalene-1(2H),2'-oxiran]-5-yl]ethyl]furan-2(5H)-one · 4-[2-[(1R)-8aα-乙酰氧基甲基-3,4,4aβ,5,6,7,8,8a-八氢-8α-羟基-5α,6α-二甲基螺[萘-1(2H),2'-环氧乙烷]-5-基]乙基]呋喃-2(5H)-酮
Category: organic chemicals
The CAS registry number of 4-[2-[(1R)-8aα-Acetoxymethyl-3,4,4aβ,5,6,7,8,8a-octahydro-8α-hydroxy-5α,6α-dimethylspiro[naphthalene-1(2H),2'-oxiran]-5-yl]ethyl]furan-2(5H)-one is 62640-06-6.
Molecular formula C22H32O6, molecular weight 392.5.
It is also registered under: 4-[2-[(1R)-8aα-Acetoxymethyl-3,4,4aβ,5,6,7,8,8a-octahydro-8α-hydroxy-5α,6α-dimethylspiro[naphthalene-1(2H),2'-oxiran]-5-yl]ethyl]furan-2(5H)-one, 4-[2-[(1R)-8aα-乙酰氧基甲基-3,4,4aβ,5,6,7,8,8a-八氢-8α-羟基-5α,6α-二甲基螺[萘-1(2H),2'-环氧乙烷]-5-基]乙基]呋喃-2(5H)-酮.
Category: Organic Chemicals.
Independent reference data for 4-[2-[(1R)-8aα-Acetoxymethyl-3,4,4aβ,5,6,7,8,8a-octahydro-8α-hydroxy-5α,6α-dimethylspiro[naphthalene-1(2H),2'-oxiran]-5-yl]ethyl]furan-2(5H)-one (CAS 62640-06-6), compiled from public chemistry databases.
| CAS 号 | 62640-06-6 |
|---|---|
| PubChem CID | 3085250 |
| 分子式 | C22H32O6 |
| IUPAC 名称 | [(4R,4aR,5S,7R,8S,8aR)-5-hydroxy-7,8-dimethyl-8-[2-(5-oxo-2H-furan-3-yl)ethyl]spiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-4a-yl]methyl acetate |
| UNII（FDA） | 30Y1ZRM6UE |
| Molecular Weight | 392.5 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 392.21988874 |
| Monoisotopic Mass | 392.21988874 |
| Topological Polar Surface Area | 85.4 |
| Heavy Atom Count | 28 |
Ajugarin II; 62640-06-6; ajugarin-ii; UNII-30Y1ZRM6UE; 30Y1ZRM6UE; AJUGARIN-II [MI]; orb1698617; DTXSID00978199; AKOS040750255; FA160198; T29789; AO-222/41148783; Q27255975
4-[2-[(1R)-8aα-乙酰氧基甲基-3,4,4aβ,5,6,7,8,8a-八氢-8α-羟基-5α,6α-二甲基螺[萘-1(2H),2'-环氧乙烷]-5-基]乙基]呋喃-2(5H)-酮 · CAS 62640-06-6 · C22H32O6. UNII 30Y1ZRM6UE.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-[2-[(1R)-8aα-乙酰氧基甲基-3,4,4aβ,5,6,7,8,8a-八氢-8α-羟基-5α,6α-二甲基螺[萘-1(2H),2'-环氧乙烷]-5-基]乙基]呋喃-2(5H)-酮