Acetic acid, 2,2-(1S,3S,7R,8E,11S,12S,15S,17R,21R,23R,25S)-12,25-bis(acetyloxy)-1,11,21-trihydroxy-17-(1R)-1-hydroxyethyl-10,10,26,26-tetramethyl-19-oxo-18,27,28,29-tetraoxatetracyclo21.3.1.13,7.111,15nonacos-8-ene-5,13-diylidenebis-, dimethyl ester, (25Z) (CAS 97850-05-0) — formula C41H60O17, molecular weight 824.9; category organic chemicals.
| CAS Number | 97850-05-0 |
|---|---|
| Molecular Formula | C41H60O17 |
| Molecular Weight | 824.9 |
| LogP | 1.5 |
| Category | Organic Chemicals |
Acetic acid, 2,2-(1S,3S,7R,8E,11S,12S,15S,17R,21R,23R,25S)-12,25-bis(acetyloxy)-1,11,21-trihydroxy-17-(1R)-1-hydroxyethyl-10,10,26,26-tetramethyl-19-oxo-18,27,28,29-tetraoxatetracyclo21.3.1.13,7.111,15nonacos-8-ene-5,13-diylidenebis-, dimethyl ester, (25Z) is a carbon-based organic compound with CAS registry number 97850-05-0 and molecular formula C41H60O17 (molecular weight 824.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 97850-05-0
Its molecular formula C41H60O17 comprises 41 C, 60 H, 17 O atoms.
Also known as: Acetic acid, 2,2-(1S,3S,7R,8E,11S,12S,15S,17R,21R,23R,25S)-12,25-bis(acetyloxy)-1,11,21-trihydroxy-17-(1R)-1-hydroxyethyl-10,10,26,26-tetramethyl-19-oxo-18,27,28,29-tetraoxatetracyclo21.3.1.13,7.111,15nonacos-8-ene-5,13-diylidenebis-, dimethyl ester, (25Z) · 乙酸， 2,2-(1S,3S,7R,8E,11S,12S,15S,17R,21R,23R,25S)-12,25-双(乙酰氧基)-1,11,21-三羟基-17-(1R)-1-羟乙基-1 0,10,26,26-四甲基-19-氧代-18,27,28,29-四氧四环21.3.1.13,7.111,15nonacos-8-烯-5,13-二亚基双-,二甲酯，（25Z
Category: organic chemicals
The CAS registry number of Acetic acid, 2,2-(1S,3S,7R,8E,11S,12S,15S,17R,21R,23R,25S)-12,25-bis(acetyloxy)-1,11,21-trihydroxy-17-(1R)-1-hydroxyethyl-10,10,26,26-tetramethyl-19-oxo-18,27,28,29-tetraoxatetracyclo21.3.1.13,7.111,15nonacos-8-ene-5,13-diylidenebis-, dimethyl ester, (25Z) is 97850-05-0.
Molecular formula C41H60O17, molecular weight 824.9.
It is also registered under: Acetic acid, 2,2-(1S,3S,7R,8E,11S,12S,15S,17R,21R,23R,25S)-12,25-bis(acetyloxy)-1,11,21-trihydroxy-17-(1R)-1-hydroxyethyl-10,10,26,26-tetramethyl-19-oxo-18,27,28,29-tetraoxatetracyclo21.3.1.13,7.111,15nonacos-8-ene-5,13-diylidenebis-, dimethyl ester, (25Z), 乙酸， 2,2-(1S,3S,7R,8E,11S,12S,15S,17R,21R,23R,25S)-12,25-双(乙酰氧基)-1,11,21-三羟基-17-(1R)-1-羟乙基-1 0,10,26,26-四甲基-19-氧代-18,27,28,29-四氧四环21.3.1.13,7.111,15nonacos-8-烯-5,13-二亚基双-,二甲酯，（25Z.
Category: Organic Chemicals.
Independent reference data for Acetic acid, 2,2-(1S,3S,7R,8E,11S,12S,15S,17R,21R,23R,25S)-12,25-bis(acetyloxy)-1,11,21-trihydroxy-17-(1R)-1-hydroxyethyl-10,10,26,26-tetramethyl-19-oxo-18,27,28,29-tetraoxatetracyclo21.3.1.13,7.111,15nonacos-8-ene-5,13-diylidenebis-, dimethyl ester, (25Z) (CAS 97850-05-0), compiled from public chemistry databases.
| CAS 号 | 97850-05-0 |
|---|---|
| PubChem CID | 10101973 |
| 分子式 | C41H60O17 |
| IUPAC 名称 | methyl (2Z)-2-[(1S,3S,7R,8E,11S,12S,13E,15S,17R,21R,23R,25S)-12,25-diacetyloxy-1,11,21-trihydroxy-17-[(1R)-1-hydroxyethyl]-13-(2-methoxy-2-oxoethylidene)-10,10,26,26-tetramethyl-19-oxo-18,27,28,29-tetraoxatetracyclo[21.3.1.13,7.111,15]nonacos-8-en-5-ylidene]acetate |
| UNII（FDA） | BDBM102423 |
| Molecular Weight | 824.9 |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 17 |
| Rotatable Bond Count | 9 |
| Exact Mass | 824.38305044 |
| Monoisotopic Mass | 824.38305044 |
| Topological Polar Surface Area | 240 |
| Heavy Atom Count | 58 |
Bryostatin 7; DTXSID901036998; 97850-05-0; RefChem:121778; DTXCID801521087; SCHEMBL17525916; BDBM102423
乙酸， 2,2-(1S,3S,7R,8E,11S,12S,15S,17R,21R,23R,25S)-12,25-双(乙酰氧基)-1,11,21-三羟基-17-(1R)-1-羟乙基-1 0,10,26,26-四甲基-19-氧代-18,27,28,29-四氧四环21.3.1.13,7.111,15nonacos-8-烯-5,13-二亚基双-,二甲酯，（25Z · CAS 97850-05-0 · C41H60O17. UNII BDBM102423.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.