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dihydrolysergic acid

  • Formula: C16H18N2O2

  • Molecular weight: 270.33

  • Smiles: CN1CC(CC2C1CC3=CNC4=CC=CC2=C34)C(=O)O

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dihydrolysergic acid

Names
Structural Information
Physico-chemical Properties
ADME
Toxicity
Medical Chemistry
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Names

  • Mycotoxin name: dihydrolysergic acid

  • First synonym: None

  • Synonyms: 5878-43-3,9,10-Dihydrolysergic acid,6-Methylergoline-8beta-carboxylic acid,UNII-CT5L8OXT9Q,CT5L8OXT9Q,Dihydrolysergic acid,EINECS 227-551-1,(6aR,9R,10aR)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxylic acid,(6As,9R,10aR)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxylic acid,9,10-Dihydro-D-lysergic acid,Ergoline-8-carboxylic acid, 6-methyl-, (8.beta.)-,SCHEMBL4668976,LYSERGIC ACID, DIHYDRO-,ORBSYPFBZQJNJE-MPKXVKKWSA-N,9,10-DIHYDROLYSERGIC ACID I,AKOS027325690,6-METHYL-8.BETA.-CARBOXYERGOLINE,9,10.ALPHA.-DIHYDROLYSERGIC ACID,9,10-DIHYDROLYSERGIC ACID, (-)-,DB-219893,NS00047357,6-METHYL-8.BETA.-ERGOLINECARBOXYLIC ACID,(5R,8R,10R)-6-Methyl-ergoline-8-carboxylic acid,CODERGOCRINE MESILATE IMPURITY H [EP IMPURITY],ERGOLINE-8.BETA.-CARBOXYLIC ACID, 6-METHYL-,Q27275753,(6aR,9R,10aR)-7-methyl-4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg]quinoline-9-carboxylic acid

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Structure

  • Smiles: CN1CC(CC2C1CC3=CNC4=CC=CC2=C34)C(=O)O

  • Isomeric smiles: CN1C[C@@H](C[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)O

  • Inchi: InChI=1S/C16H18N2O2/c1-18-8-10(16(19)20)5-12-11-3-2-4-13-15(11)9(7-17-13)6-14(12)18/h2-4,7,10,12,14,17H,5-6,8H2,1H3,(H,19,20)/t10-,12-,14-/m1/s1

  • Inchikey: ORBSYPFBZQJNJE-MPKXVKKWSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C16H18N2O2

  • Molecular weight: 270.33

  • Monoisotopic mass: 270.136827821

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