4-(aminomethyl)-5-(hydroxymethyl)-6-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl]-2-methyl-pyridin-3-ol

Systemtic Name: 4-(aminomethyl)-5-(hydroxymethyl)-6-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl]-2-methyl-pyridin-3-ol Openeye Name: 4-(aminomethyl)-6-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridyl]methyl]-5-(hydroxymethyl)-2-methyl-pyridin-3-ol CAS Name: 4-(aminomethyl)-6-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methyl]-5-(hydroxymethyl)-2-methyl-3-pyridinol IUPAC Name: 4-(aminomethyl)-6-[[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol Traditional Name: 4-(aminomethyl)-6-[(3-hydroxy-2-methyl-5-methylol-4-pyridyl)methyl]-2-methyl-5-methylol-pyridin-3-ol Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)CC2=C(C(=NC=C2CO)C)O)CO)CN)O

Isomeric SMILES

CC1=C(C(=C(C(=N1)CC2=C(C(=NC=C2CO)C)O)CO)CN)O

InChI

InChI=1S/C16H21N3O4/c1-8-15(22)11(10(6-20)5-18-8)3-14-13(7-21)12(4-17)16(23)9(2)19-14/h5,20-23H,3-4,6-7,17H2,1-2H3