ZQT
Summary
| Name: | 9H-xanthene-1,3,6,8-tetrol |
| Formula: | C13 H10 O5 |
| Formal charge: | 0 |
| Formula weight: | 246.215 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 9H-xanthene-1,3,6,8-tetrol |
| OpenEye OEToolkits | 2.0.7 | 9~{H}-xanthene-1,3,6,8-tetrol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Oc1cc(O)cc2Oc3cc(O)cc(O)c3Cc21 |
| InChI | InChI | 1.06 | InChI=1S/C13H10O5/c14-6-1-10(16)8-5-9-11(17)2-7(15)4-13(9)18-12(8)3-6/h1-4,14-17H,5H2 |
| InChIKey | InChI | 1.06 | WRWDLBILCDUPOS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1cc(O)c2Cc3c(O)cc(O)cc3Oc2c1 |
| SMILES | CACTVS | 3.385 | Oc1cc(O)c2Cc3c(O)cc(O)cc3Oc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(cc2c(c1O)Cc3c(cc(cc3O2)O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(cc2c(c1O)Cc3c(cc(cc3O2)O)O)O |
