2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine-18-carboxylic acid
Chemical Structure Depiction of
2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine-18-carboxylic acid
2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine-18-carboxylic acid
Compound characteristics
| Compound ID: | 0242-0459 |
| Compound Name: | 2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine-18-carboxylic acid |
| Molecular Weight: | 356.37 |
| Molecular Formula: | C17 H24 O8 |
| Smiles: | C1COCCOCCOc2cc(ccc2OCCOCCO1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3752 |
| logD: | -1.6727 |
| logSw: | -1.3824 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.435 |
| InChI Key: | GFQYJVLOPVAPGJ-UHFFFAOYSA-N |