[(4,5-dimethoxy-7,11,12-trioxo-1,2,2b,8,9,9a,9b,10,11,12-decahydro-7H-2a,10-methano-6b,12a-diazacyclobuta[4,5]cycloocta[1,2,3-jk]fluoren-9-yl)oxy]acetic acid
Chemical Structure Depiction of
[(4,5-dimethoxy-7,11,12-trioxo-1,2,2b,8,9,9a,9b,10,11,12-decahydro-7H-2a,10-methano-6b,12a-diazacyclobuta[4,5]cycloocta[1,2,3-jk]fluoren-9-yl)oxy]acetic acid
[(4,5-dimethoxy-7,11,12-trioxo-1,2,2b,8,9,9a,9b,10,11,12-decahydro-7H-2a,10-methano-6b,12a-diazacyclobuta[4,5]cycloocta[1,2,3-jk]fluoren-9-yl)oxy]acetic acid
Compound characteristics
| Compound ID: | 4185-0030 |
| Compound Name: | [(4,5-dimethoxy-7,11,12-trioxo-1,2,2b,8,9,9a,9b,10,11,12-decahydro-7H-2a,10-methano-6b,12a-diazacyclobuta[4,5]cycloocta[1,2,3-jk]fluoren-9-yl)oxy]acetic acid |
| Molecular Weight: | 456.45 |
| Molecular Formula: | C23 H24 N2 O8 |
| Smiles: | COc1cc2C3C4C(C5CC36CCN6C(C5=O)=O)C(CC(N4c2cc1OC)=O)OCC(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | -0.1894 |
| logD: | -3.9504 |
| logSw: | -1.3571 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.977 |
| InChI Key: | RXLPSBUAFKMRNI-UHFFFAOYSA-N |