2-[8-[[(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbonyl]amino]octanoylamino]benzoic acid
Modify Date: 2025-10-13 00:31:29
![2-[8-[[(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbonyl]amino]octanoylamino]benzoic acid Structure](https://image.chemsrc.com/caspic/284/174740-59-1.png)
2-[8-[[(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbonyl]amino]octanoylamino]benzoic acid structure
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Common Name | 2-[8-[[(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbonyl]amino]octanoylamino]benzoic acid | ||
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| CAS Number | 174740-59-1 | Molecular Weight | 717.03200 | |
| Density | 1.11g/cm3 | Boiling Point | 842.2ºC at 760 mmHg | |
| Molecular Formula | C45H68N2O5 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 463.1ºC | |
| Name | 2-[8-[[(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbonyl]amino]octanoylamino]benzoic acid |
|---|
| Density | 1.11g/cm3 |
|---|---|
| Boiling Point | 842.2ºC at 760 mmHg |
| Molecular Formula | C45H68N2O5 |
| Molecular Weight | 717.03200 |
| Flash Point | 463.1ºC |
| Exact Mass | 716.51300 |
| PSA | 122.71000 |
| LogP | 11.28840 |
| Vapour Pressure | 3.99E-30mmHg at 25°C |
| Index of Refraction | 1.558 |
| InChIKey | QQFSLQMZRCCYKX-FUZKAIMQSA-N |
| SMILES | C=C(C)C1CCC2(C(=O)NCCCCCCCC(=O)Nc3ccccc3C(=O)O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C12 |