(3S)-5β,6α,7α-Triacetoxy-3aα,4,4a,5,6,7,7aα,8,9,9aα-decahydro-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2(3H)-one (CAS 62121-29-3) — formula C21H30O8, molecular weight 410.5; category organic chemicals.
| CAS Number | 62121-29-3 |
|---|---|
| Molecular Formula | C21H30O8 |
| Molecular Weight | 410.5 |
| LogP | 2.6 |
| Category | Organic Chemicals |
(3S)-5β,6α,7α-Triacetoxy-3aα,4,4a,5,6,7,7aα,8,9,9aα-decahydro-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2(3H)-one is a carbon-based organic compound with CAS registry number 62121-29-3 and molecular formula C21H30O8 (molecular weight 410.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 62121-29-3
Its molecular formula C21H30O8 comprises 21 C, 30 H, 8 O atoms.
Also known as: (3S)-5β,6α,7α-Triacetoxy-3aα,4,4a,5,6,7,7aα,8,9,9aα-decahydro-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2(3H)-one · (3S)-5β,6α,7α-三乙酰氧基-3aα,4,4a,5,6,7,7aα,8,9,9aα-十氢-3β,4aβ,8α-三甲基甘蓝[6,5-b]呋喃-2(3H)-酮
Category: organic chemicals
The CAS registry number of (3S)-5β,6α,7α-Triacetoxy-3aα,4,4a,5,6,7,7aα,8,9,9aα-decahydro-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2(3H)-one is 62121-29-3.
Molecular formula C21H30O8, molecular weight 410.5.
It is also registered under: (3S)-5β,6α,7α-Triacetoxy-3aα,4,4a,5,6,7,7aα,8,9,9aα-decahydro-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2(3H)-one, (3S)-5β,6α,7α-三乙酰氧基-3aα,4,4a,5,6,7,7aα,8,9,9aα-十氢-3β,4aβ,8α-三甲基甘蓝[6,5-b]呋喃-2(3H)-酮.
Category: Organic Chemicals.
Independent reference data for (3S)-5β,6α,7α-Triacetoxy-3aα,4,4a,5,6,7,7aα,8,9,9aα-decahydro-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2(3H)-one (CAS 62121-29-3), compiled from public chemistry databases.
| CAS 号 | 62121-29-3 |
|---|---|
| PubChem CID | 173848 |
| 分子式 | C21H30O8 |
| IUPAC 名称 | [(1S,3aR,5R,5aS,6R,7R,8R,8aS,9aR)-7,8-diacetyloxy-1,5,8a-trimethyl-2-oxo-1,3a,4,5,5a,6,7,8,9,9a-decahydroazuleno[6,5-b]furan-6-yl] acetate |
| UNII（FDA） | 66LXL83CAC |
| Molecular Weight | 410.5 |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 410.19406791 |
| Monoisotopic Mass | 410.19406791 |
| Topological Polar Surface Area | 105 |
| Heavy Atom Count | 29 |
Hymenolane; BRN 1357654; 62121-29-3; DTXSID90211183; RefChem:147330; DTXCID90133674; 66LXL83CAC; (3S,3aR,4aS,5R,6R,7R,7aS,8R,9aR)-3,4a,8-Trimethyl-2-oxododecahydroazuleno[6,5-b]furan-5,6,7-triyl triacetate; (3S,3aR,4aS,5R,6R,7R,7aS,8R,9aR)-5,6,7-Tris(acetyloxy)decahydro-3,4a,8-trimethylazuleno[6,5-b]furan-2(3H)-one
(3S)-5β,6α,7α-三乙酰氧基-3aα,4,4a,5,6,7,7aα,8,9,9aα-十氢-3β,4aβ,8α-三甲基甘蓝[6,5-b]呋喃-2(3H)-酮 · CAS 62121-29-3 · C21H30O8. UNII 66LXL83CAC.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: (3S)-5β,6α,7α-三乙酰氧基-3aα,4,4a,5,6,7,7aα,8,9,9aα-十氢-3β,4aβ,8α-三甲基甘蓝[6,5-b]呋喃-2(3H)-酮