(3,4-dihydroquinolin-1(2H)-yl)[(5S,6S,7S,8S)-8-hydroxy-7-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-2H-naphtho[2,3-d][1,3]dioxol-6-yl]methanone
Chemical Structure Depiction of
(3,4-dihydroquinolin-1(2H)-yl)[(5S,6S,7S,8S)-8-hydroxy-7-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-2H-naphtho[2,3-d][1,3]dioxol-6-yl]methanone
(3,4-dihydroquinolin-1(2H)-yl)[(5S,6S,7S,8S)-8-hydroxy-7-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-2H-naphtho[2,3-d][1,3]dioxol-6-yl]methanone
Compound characteristics
| Compound ID: | N124-0034 |
| Compound Name: | (3,4-dihydroquinolin-1(2H)-yl)[(5S,6S,7S,8S)-8-hydroxy-7-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-2H-naphtho[2,3-d][1,3]dioxol-6-yl]methanone |
| Molecular Weight: | 547.61 |
| Molecular Formula: | C31 H33 N O8 |
| Smiles: | [H][C@]1(CO)[C@@H](c2cc3c(cc2[C@H](c2cc(c(c(c2)OC)OC)OC)[C@]1([H])C(N1CCCc2ccccc12)=O)OCO3)O |
| Stereo: | ABSOLUTE |
| logP: | 3.2111 |
| logD: | 3.2111 |
| logSw: | -3.5239 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.918 |
| InChI Key: | XJRDDXHNJRIVQR-UQMGHXSLSA-N |