(3aS,4S,5S,6E,10E,11aR)-2,3,3a,4,5,8,9,11a-Octahydro-5-hydroxy-10-methyl-3-methylene-4-[[(Z)-2-methyl-1-oxo-2-butenyl]oxy]-2-oxocyclodeca[b]furan-6-carboxylic acid methyl ester (CAS 72023-29-1) — formula C21H26O7, molecular weight 390.4; category organic chemicals.
| CAS Number | 72023-29-1 |
|---|---|
| Molecular Formula | C21H26O7 |
| Molecular Weight | 390.4 |
| LogP | 2.7 |
| Category | Organic Chemicals |
(3aS,4S,5S,6E,10E,11aR)-2,3,3a,4,5,8,9,11a-Octahydro-5-hydroxy-10-methyl-3-methylene-4-[[(Z)-2-methyl-1-oxo-2-butenyl]oxy]-2-oxocyclodeca[b]furan-6-carboxylic acid methyl ester is a carbon-based organic compound with CAS registry number 72023-29-1 and molecular formula C21H26O7 (molecular weight 390.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 72023-29-1
Its molecular formula C21H26O7 comprises 21 C, 26 H, 7 O atoms.
Also known as: (3aS,4S,5S,6E,10E,11aR)-2,3,3a,4,5,8,9,11a-Octahydro-5-hydroxy-10-methyl-3-methylene-4-[[(Z)-2-methyl-1-oxo-2-butenyl]oxy]-2-oxocyclodeca[b]furan-6-carboxylic acid methyl ester · (3aS,4S,5S,6E,10E,11aR)-2,3,3a,4,5,8,9,11a-八氢-5-羟基-10-甲基-3-亚甲基-4-[[(Z)-2-甲基-1-氧代-2-丁烯基]氧基]-2-氧代环十[b]呋喃-6-甲酸甲酯
Category: organic chemicals
The CAS registry number of (3aS,4S,5S,6E,10E,11aR)-2,3,3a,4,5,8,9,11a-Octahydro-5-hydroxy-10-methyl-3-methylene-4-[[(Z)-2-methyl-1-oxo-2-butenyl]oxy]-2-oxocyclodeca[b]furan-6-carboxylic acid methyl ester is 72023-29-1.
Molecular formula C21H26O7, molecular weight 390.4.
It is also registered under: (3aS,4S,5S,6E,10E,11aR)-2,3,3a,4,5,8,9,11a-Octahydro-5-hydroxy-10-methyl-3-methylene-4-[[(Z)-2-methyl-1-oxo-2-butenyl]oxy]-2-oxocyclodeca[b]furan-6-carboxylic acid methyl ester, (3aS,4S,5S,6E,10E,11aR)-2,3,3a,4,5,8,9,11a-八氢-5-羟基-10-甲基-3-亚甲基-4-[[(Z)-2-甲基-1-氧代-2-丁烯基]氧基]-2-氧代环十[b]呋喃-6-甲酸甲酯.
Category: Organic Chemicals.
Independent reference data for (3aS,4S,5S,6E,10E,11aR)-2,3,3a,4,5,8,9,11a-Octahydro-5-hydroxy-10-methyl-3-methylene-4-[[(Z)-2-methyl-1-oxo-2-butenyl]oxy]-2-oxocyclodeca[b]furan-6-carboxylic acid methyl ester (CAS 72023-29-1), compiled from public chemistry databases.
| CAS 号 | 72023-29-1 |
|---|---|
| PubChem CID | 101324863 |
| 分子式 | C21H26O7 |
| IUPAC 名称 | methyl (3aS,4S,5S,6E,10E,11aR)-5-hydroxy-10-methyl-4-[(Z)-2-methylbut-2-enoyl]oxy-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate |
| Molecular Weight | 390.4 |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 390.16785316 |
| Monoisotopic Mass | 390.16785316 |
| Topological Polar Surface Area | 99.1 |
| Heavy Atom Count | 28 |
RefChem:929798; 72023-29-1; CHEMBL4072671
(3aS,4S,5S,6E,10E,11aR)-2,3,3a,4,5,8,9,11a-八氢-5-羟基-10-甲基-3-亚甲基-4-[[(Z)-2-甲基-1-氧代-2-丁烯基]氧基]-2-氧代环十[b]呋喃-6-甲酸甲酯 · CAS 72023-29-1 · C21H26O7.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.