A1H66
Summary
| Name: | (6aR,10aR)-9-(hydroxymethyl)-6,6-dimethyl-3-(2-methyloctan-2-yl)-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-ol |
| Synonyms: | D9-THC analog HU-210 |
| Formula: | C25 H38 O3 |
| Formal charge: | 0 |
| Formula weight: | 386.567 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (6~{a}~{R},10~{a}~{R})-9-(hydroxymethyl)-6,6-dimethyl-3-(2-methyloctan-2-yl)-6~{a},7,10,10~{a}-tetrahydrobenzo[c]chromen-1-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C25H38O3/c1-6-7-8-9-12-24(2,3)18-14-21(27)23-19-13-17(16-26)10-11-20(19)25(4,5)28-22(23)15-18/h10,14-15,19-20,26-27H,6-9,11-13,16H2,1-5H3/t19-,20-/m1/s1 |
| InChIKey | InChI | 1.06 | SSQJFGMEZBFMNV-WOJBJXKFSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCC(C)(C)c1cc(O)c2[C@@H]3CC(=CC[C@H]3C(C)(C)Oc2c1)CO |
| SMILES | CACTVS | 3.385 | CCCCCCC(C)(C)c1cc(O)c2[CH]3CC(=CC[CH]3C(C)(C)Oc2c1)CO |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCC(C)(C)c1cc(c2c(c1)OC([C@H]3[C@H]2CC(=CC3)CO)(C)C)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCC(C)(C)c1cc(c2c(c1)OC(C3C2CC(=CC3)CO)(C)C)O |
