BDBM36085 (1R,2R,5R)-2-hydroxy-3-pinanone
SMILES: CC1(C)C2CC1[C@@](C)(O)C(=O)C2
InChI Key: InChIKey=VZRRCQOUNSHSGB-HNQUHTCLSA-N
Data: 1 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 | BDBM36085 | CHEBI KEGG MMDB PC cid PC sid PDB | PC cid PC sid | -4.61 | 0.0498 | -4.66 | 3.37 | 6.90 | 25 | |
Japan Science and Technology Agency | J Am Chem Soc 122: 4418-35 (2000) |