Record Information |
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Version |
1.0 |
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Update Date |
1/22/2018 11:54:54 AM |
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Metabolite ID | PAMDB110441 |
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Identification |
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Name: |
(1S,2R)-1-C-(indol-3-yl)glycerol 3-phosphate |
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Description: | Dianion of (1S,2R)-1-C-(indol-3-yl)glycerol 3-phosphate arising from deprotonation of both phosphate OH groups. |
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Structure |
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Synonyms: | -
C1-(3-Indolyl)-glycerol 3-phosphate
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indole-3-glycerol-P
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1-(indol-3-yl)glycerol-3-P
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1-(indol-3-yl)glycerol-3-phosphate
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indoleglycerol phosphate
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indole-3-glycerol-phosphate
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Chemical Formula: |
C11H12NO6P
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Average Molecular Weight: |
285.19 |
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Monoisotopic Molecular
Weight: |
287.0558736972 |
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InChI Key: |
NQEQTYPJSIEPHW-MNOVXSKESA-L |
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InChI: |
InChI=1S/C11H14NO6P/c13-10(6-18-19(15,16)17)11(14)8-5-12-9-4-2-1-3-7(8)9/h1-5,10-14H,6H2,(H2,15,16,17)/p-2/t10-,11+/m1/s1 |
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CAS
number: |
Not Available |
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IUPAC Name: | (2R,3S)-2,3-dihydroxy-3-(1H-indol-3-yl)propyl phosphate |
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Traditional IUPAC Name: |
Not Available |
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SMILES: | C2(=C(C1(C=CC=CC=1N2))C(C(COP([O-])(=O)[O-])O)O) |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position. |
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Kingdom |
Organic compounds |
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Super Class | Organoheterocyclic compounds |
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Class |
Indoles and derivatives |
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Sub Class | Indoles |
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Direct Parent |
3-alkylindoles |
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Alternative Parents |
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Substituents |
- 3-alkylindole
- Organic phosphoric acid derivative
- Phosphoric acid ester
- Substituted pyrrole
- Alkyl phosphate
- Benzenoid
- Pyrrole
- Heteroaromatic compound
- Secondary alcohol
- 1,2-diol
- Azacycle
- Hydrocarbon derivative
- Organic oxide
- Aromatic alcohol
- Organopnictogen compound
- Organic oxygen compound
- Organooxygen compound
- Organonitrogen compound
- Organic nitrogen compound
- Alcohol
- Organic anion
- Aromatic heteropolycyclic compound
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Molecular Framework |
Aromatic heteropolycyclic compounds |
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External Descriptors |
- organophosphate oxoanion (CHEBI:60820)
- an indole-containing compound (INDOLE-3-GLYCEROL-P)
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Physical Properties |
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State: |
Not Available |
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Charge: | -2 |
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Melting point: |
Not Available |
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Experimental Properties: |
Not Available |
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Predicted Properties |
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Biological Properties |
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Cellular Locations: |
Not Available |
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Reactions: | |
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Pathways: |
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Spectra |
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Spectra: |
Not Available |
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References |
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References: |
Not Available |
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Synthesis Reference: |
Not Available |
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Material Safety Data Sheet (MSDS) |
Not Available |
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Links |
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External Links: |
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