BDBM36169 glycocholate (GCA)
SMILES: CC(CCC(=O)NCC([O-])=O)[C@H]1CCC2C3[C@@H](O)CC4C[C@H](O)CC[C@]4(C)C3C[C@H](O)[C@]12C
InChI Key: InChIKey=RFDAIACWWDREDC-XOLZFWJXSA-M
Data: 7 ITC
Cell (A) | Syringe (B) | Cell Links | Syringe Links | Cell + Syr Links | ΔG° kcal/mole | -TΔS° kcal/mole | ΔH° kcal/mole | log K | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|
BDBM11 | BDBM36169 | CHEBI KEGG MMDB PC cid PC sid PDB | PC cid PC sid | n/a | 0.883 | -5.49 | 3.37 | 7.20 | 25 | |
Nankai University | J Org Chem 70: 8703-11 (2005) | |||||||||
BDBM36166 | BDBM36169 | PC cid PC sid | PC cid PC sid | n/a | 1.42 | -5.59 | 3.05 | 7.20 | 25 | |
Nankai University | J Org Chem 70: 8703-11 (2005) | |||||||||
BDBM36167 | BDBM36169 | PC cid PC sid | PC cid PC sid | n/a | 1.53 | -5.95 | 3.25 | 7.20 | 25 | |
Nankai University | J Org Chem 70: 8703-11 (2005) | |||||||||
BDBM11 | BDBM36169 | CHEBI KEGG MMDB PC cid PC sid PDB | PC cid PC sid | -4.61 | 0.883 | -5.49 | 3.38 | 7.20 | 25 | |
Nankai University | J Phys Chem B 107: 14130 (2003) | |||||||||
BDBM36127 | BDBM36169 | CHEBI PC cid PC sid | PC cid PC sid | -4.52 | 1.67 | -6.19 | 3.32 | 7.20 | 25 | |
Nankai University | J Phys Chem B 107: 14130 (2003) | |||||||||
BDBM36171 | BDBM36169 | PC cid PC sid | PC cid PC sid | -4.56 | 0.157 | -4.72 | 3.35 | 7.20 | 25 | |
Nankai University | J Phys Chem B 107: 14130 (2003) | |||||||||
BDBM36172 | BDBM36169 | PC cid PC sid | PC cid PC sid | -4.90 | 1.01 | -5.91 | 3.59 | 7.20 | 25 | |
Nankai University | J Phys Chem B 107: 14130 (2003) |