Guar gum
Relevant Data
Food Additives Approved in the United States
Food Additives Approved by WHO:
General Information
| Chemical name | Guar gum |
| E No. | E 412 |
| INS. | 412 |
| CAS number | 9000-30-0 |
| Group | No |
| Component of the group |
Group I, Additives (Group I) |
From webgate.ec.europa.eu
Authorisation of the use of this additive in Food Additives
The additive is authorised to be used in the following category(ies):
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From webgate.ec.europa.eu
Computed Descriptors
Download SDF| 2D Structure | |
| CID | 44134661 |
| IUPAC Name | disodium;[[[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-oxidophosphoryl] hydrogen phosphate |
| InChI | InChI=1S/C10H16N5O12P3.2Na/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(25-7)2-24-29(20,21)27-30(22,23)26-28(17,18)19;;/h3-7,16H,1-2H2,(H,20,21)(H,22,23)(H2,11,12,13)(H2,17,18,19);;/q;2*+1/p-2 |
| InChI Key | JEKDCIBJADJZSK-UHFFFAOYSA-L |
| Canonical SMILES | C1C(C(OC1N2C=NC3=C2N=CN=C3N)COP(=O)(O)OP(=O)([O-])OP(=O)(O)[O-])O.[Na+].[Na+] |
| Molecular Formula | |
| Wikipedia | Guar gum |
From Pubchem
Computed Properties
| Property Name | Property Value |
|---|---|
| Molecular Weight | 535.146 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 16 |
| Rotatable Bond Count | 8 |
| Complexity | 758.0 |
| CACTVS Substructure Key Fingerprint | A A A D c c B z v D M A A A A A A A A A A A A A A A A A A W J A A A A s A A A A A A A A A F g B + A A A H g A Q C C A A C B z h l w Y F 8 L 9 M F x C g Q Q Z h Z I C A g C 0 R E K A B U C A o V B C B W A J A y E A e R A g P A A L D A C C w M A I A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A = = |
| Topological Polar Surface Area | 265.0 |
| Monoisotopic Mass | 534.965 |
| Exact Mass | 534.965 |
| Compound Is Canonicalized | True |
| Formal Charge | 0 |
| Heavy Atom Count | 32 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Isotope Atom Count | 0 |
| Covalently-Bonded Unit Count | 3 |
From Pubchem
Taxonomic Classification
| Kingdom | Organic compounds |
|---|---|
| Superclass | Nucleosides, nucleotides, and analogues |
| Class | Purine nucleotides |
| Subclass | Purine deoxyribonucleotides |
| Intermediate Tree Nodes | Purine deoxyribonucleoside triphosphates |
| Direct Parent | Purine 2'-deoxyribonucleoside triphosphates |
| Alternative Parents |
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| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Purine 2'-deoxyribonucleoside triphosphate - 6-aminopurine - Imidazopyrimidine - Purine - Aminopyrimidine - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Imidolactam - Pyrimidine - Alkyl phosphate - Azole - Imidazole - Heteroaromatic compound - Tetrahydrofuran - Secondary alcohol - Oxacycle - Azacycle - Organoheterocyclic compound - Organic alkali metal salt - Organic zwitterion - Primary amine - Organic sodium salt - Organooxygen compound - Organonitrogen compound - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Amine - Alcohol - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as purine 2'-deoxyribonucleoside triphosphates. These are purine nucleotides with triphosphate group linked to the ribose moiety lacking a hydroxyl group at position 2. |
From ClassyFire