A1EP1
Summary
| Name: | (6~{a}~{R},11~{a}~{R})-9-methoxy-6~{a},11~{a}-dihydro-6~{H}-[1]benzofuro[3,2-c]chromen-3-ol |
| Synonyms: | Medicarpin |
| Formula: | C16 H14 O4 |
| Formal charge: | 0 |
| Formula weight: | 270.28 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (6~{a}~{R},11~{a}~{R})-9-methoxy-6~{a},11~{a}-dihydro-6~{H}-[1]benzofuro[3,2-c]chromen-3-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C16H14O4/c1-18-10-3-5-11-13-8-19-14-6-9(17)2-4-12(14)16(13)20-15(11)7-10/h2-7,13,16-17H,8H2,1H3/t13-,16-/m0/s1 |
| InChIKey | InChI | 1.06 | NSRJSISNDPOJOP-BBRMVZONSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc2[C@@H]3COc4cc(O)ccc4[C@@H]3Oc2c1 |
| SMILES | CACTVS | 3.385 | COc1ccc2[CH]3COc4cc(O)ccc4[CH]3Oc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc2c(c1)O[C@@H]3[C@H]2COc4c3ccc(c4)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc2c(c1)OC3C2COc4c3ccc(c4)O |
