ZEZ
Summary
| Name: | (2Z)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol |
| Synonyms: | CIS-ZEATIN |
| Formula: | C10 H13 N5 O |
| Formal charge: | 0 |
| Formula weight: | 219.243 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2Z)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol |
| OpenEye OEToolkits | 1.5.0 | (Z)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n2c1c(ncn1)c(nc2)NC/C=C(/C)CO |
| SMILES_CANONICAL | CACTVS | 3.341 | C\C(CO)=C\CNc1ncnc2[nH]cnc12 |
| SMILES | CACTVS | 3.341 | CC(CO)=CCNc1ncnc2[nH]cnc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C/C(=C/CNc1c2c([nH]cn2)ncn1)/CO |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(=CCNc1c2c([nH]cn2)ncn1)CO |
| InChI | InChI | 1.03 | InChI=1S/C10H13N5O/c1-7(4-16)2-3-11-9-8-10(13-5-12-8)15-6-14-9/h2,5-6,16H,3-4H2,1H3,(H2,11,12,13,14,15)/b7-2- |
| InChIKey | InChI | 1.03 | UZKQTCBAMSWPJD-UQCOIBPSSA-N |
