Showing Metabocard for 4beta-carboxy-4alpha-methyl-5alpha-cholesta-8,24-dien-3beta-ol (BASm0010280)
| Common Name | 4beta-carboxy-4alpha-methyl-5alpha-cholesta-8,24-dien-3beta-ol |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C29H45O3 |
| Average Mass | 441.67700 |
| Monoisotopic Mass | 441.33742 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | CC(C)=CCC[C@@H](C)[C@H]1CC[C@H]2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)[C@](C)(C(=O)[O-])[C@@H]1CC3 |
| InChI Identifier | InChI=1S/C29H46O3/c1-18(2)8-7-9-19(3)21-11-12-22-20-10-13-24-28(5,23(20)14-16-27(21,22)4)17-15-25(30)29(24,6)26(31)32/h8,19,21-22,24-25,30H,7,9-17H2,1-6H3,(H,31,32)/p-1/t19-,21-,22+,24-,25+,27-,28-,29?/m1/s1 |
| InChI Key | MYWAIWDQTCHPTH-CKXAGKIBSA-M |
| CHEBI ID | CHEBI:143574 |
| MiMeDB ID | MMDBc0047879 |
| State | Expected Solid |
| Water Solubility | Not Available |
| logS | Not Available |
| pKa (Strongest Acidic) | Not Available |
| pKa (Strongest Basic) | Not Available |
| Hydrogen Acceptor Count | Not Available |
| Hydrogen Donor Count | Not Available |
| Rotatable Bond Count | Not Available |
| Physiological Charge | Not Available |
| Formal Charge | Not Available |
| Polarizability | Not Available |