| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-10-03 18:34:02 UTC |
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| Update Date | 2020-04-22 15:49:00 UTC |
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| BMDB ID | BMDB0012201 |
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| Secondary Accession Numbers | |
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| Metabolite Identification |
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| Common Name | Cis-zeatin-7-N-glucoside |
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| Description | Cis-zeatin-7-N-glucoside, also known as raphanatin, belongs to the class of organic compounds known as glycosylamines. Glycosylamines are compounds consisting of an amine with a beta-N-glycosidic bond to a carbohydrate, thus forming a cyclic hemiaminal ether bond (alpha-amino ether). Cis-zeatin-7-N-glucoside is a very strong basic compound (based on its pKa). |
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| Structure | |
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| Synonyms | | Value | Source |
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| (Z)-Zeatin-7-N-glucoside | HMDB | | 7-beta-D-Glucopyranosylzeatin | HMDB | | Raphanatin | HMDB |
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| Chemical Formula | C16H23N5O6 |
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| Average Molecular Weight | 381.3837 |
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| Monoisotopic Molecular Weight | 381.164833493 |
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| IUPAC Name | (2R,3R,4S,5S,6R)-2-(6-{[(2E)-4-hydroxy-3-methylbut-2-en-1-yl]amino}-7H-purin-7-yl)-6-(hydroxymethyl)oxane-3,4,5-triol |
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| Traditional Name | trans-zeatin-7-β-D-glucoside |
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| CAS Registry Number | Not Available |
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| SMILES | C\C(CO)=C/CNC1=C2N(C=NC2=NC=N1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
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| InChI Identifier | InChI=1S/C16H23N5O6/c1-8(4-22)2-3-17-14-10-15(19-6-18-14)20-7-21(10)16-13(26)12(25)11(24)9(5-23)27-16/h2,6-7,9,11-13,16,22-26H,3-5H2,1H3,(H,17,18,19)/b8-2+/t9-,11-,12+,13-,16-/m1/s1 |
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| InChI Key | HTDHRCLVWUEXIS-HNVSNYHQSA-N |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as glycosylamines. Glycosylamines are compounds consisting of an amine with a beta-N-glycosidic bond to a carbohydrate, thus forming a cyclic hemiaminal ether bond (alpha-amino ether). |
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| Kingdom | Organic compounds |
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| Super Class | Organic oxygen compounds |
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| Class | Organooxygen compounds |
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| Sub Class | Carbohydrates and carbohydrate conjugates |
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| Direct Parent | Glycosylamines |
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| Alternative Parents | |
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| Substituents | - Hexose monosaccharide
- N-glycosyl compound
- 6-alkylaminopurine
- 6-aminopurine
- Imidazopyrimidine
- Purine
- Aminopyrimidine
- Secondary aliphatic/aromatic amine
- Monosaccharide
- N-substituted imidazole
- Oxane
- Pyrimidine
- Imidolactam
- Azole
- Heteroaromatic compound
- Imidazole
- Secondary alcohol
- Azacycle
- Secondary amine
- Polyol
- Organoheterocyclic compound
- Oxacycle
- Primary alcohol
- Organic nitrogen compound
- Hydrocarbon derivative
- Alcohol
- Organopnictogen compound
- Organonitrogen compound
- Amine
- Aromatic heteropolycyclic compound
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| Molecular Framework | Aromatic heteropolycyclic compounds |
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| External Descriptors | |
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| Ontology |
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| Status | Expected but not Quantified |
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| Origin | |
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| Biofunction | Not Available |
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| Application | Not Available |
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| Cellular locations | Not Available |
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| Physical Properties |
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| State | Solid |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | Not Available | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | Not Available | Not Available |
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| Predicted Properties | |
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| Spectra |
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| Spectra | |
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