[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] undecanoate
Modify Date: 2025-08-22 00:54:03
![[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] undecanoate Structure](https://image.chemsrc.com/caspic/273/3571-53-7.png)
[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] undecanoate structure
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Common Name | [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] undecanoate | ||
|---|---|---|---|---|
| CAS Number | 3571-53-7 | Molecular Weight | 440.65800 | |
| Density | 1.07 g/cm3 | Boiling Point | 554.9ºC at 760 mmHg | |
| Molecular Formula | C29H44O3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 208.7ºC | |
| Name | [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] undecanoate |
|---|---|
| Synonym | More Synonyms |
| Density | 1.07 g/cm3 |
|---|---|
| Boiling Point | 554.9ºC at 760 mmHg |
| Molecular Formula | C29H44O3 |
| Molecular Weight | 440.65800 |
| Flash Point | 208.7ºC |
| Exact Mass | 440.32900 |
| PSA | 46.53000 |
| LogP | 7.69090 |
| Index of Refraction | 1.547 |
| InChIKey | TXHUMRBWIWWBGW-GVGNIZHQSA-N |
| SMILES | CCCCCCCCCCC(=O)OC1CCC2C3CCc4cc(O)ccc4C3CCC12C |
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[(8R,9S,13S,14S... CAS#:3571-53-7 |
| Literature: Annales Pharmaceutiques Francaises, , vol. 16, p. 757,760, 762 |
|
~%
[(8R,9S,13S,14S... CAS#:3571-53-7 |
| Literature: Annales Pharmaceutiques Francaises, , vol. 16, p. 757,760, 762 |
| Precursor 2 | |
|---|---|
| DownStream 0 | |
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Name: FDA HLAED, serum glutamic oxaloacetic transaminase (SGOT) increase
Source: ChEMBL
Target: Hepatotoxicity
External Id: CHEMBL1697799
|
|
Name: FDA HLAED, serum glutamic pyruvic transaminase (SGPT) increase
Source: ChEMBL
Target: Hepatotoxicity
External Id: CHEMBL1697800
|
|
Name: FDA HLAED, lactate dehydrogenase (LDH) increase
Source: ChEMBL
Target: Hepatotoxicity
External Id: CHEMBL1697801
|
|
Name: FDA HLAED, gamma-glutamyl transferase (GGT) increase
Source: ChEMBL
Target: Hepatotoxicity
External Id: CHEMBL1697802
|
|
Name: Literature-mined public compounds from Kruhlak et al phospholipidosis modelling datas...
Source: ChEMBL
Target: Phospholipidosis
External Id: CHEMBL1697855
|
|
Name: FDA HLAED, liver enzyme composite activity
Source: ChEMBL
Target: Hepatotoxicity
External Id: CHEMBL1697797
|
|
Name: FDA HLAED, alkaline phosphatase increase
Source: ChEMBL
Target: Hepatotoxicity
External Id: CHEMBL1697798
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