(4Z)-4-[(3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]imino-6-oxidanyl-pyrido[2,1-h]pteridine-9-carboxylic acid

Systemtic Name: (4Z)-4-[(3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]imino-6-oxidanyl-pyrido[2,1-h]pteridine-9-carboxylic acid Openeye Name: (4Z)-4-[(3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]imino-6-hydroxy-pyrido[2,1-h]pteridine-9-carboxylic acid CAS Name: (4Z)-4-[[(3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]imino]-6-hydroxy-9-pyrido[2,1-h]pteridinecarboxylic acid IUPAC Name: (4Z)-4-[(3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imino-6-hydroxypyrido[2,1-h]pteridine-9-carboxylic acid Traditional Name: (4Z)-4-[(3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]imino-6-hydroxy-pyrido[2,1-h]pteridine-9-carboxylic acid Formula: C16H15N5O7 MolecularWeight: 389.3196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(N=C3C(=NC=NC3=NC4C(C(C(O4)CO)O)O)N2C=C1C(=O)O)O

Isomeric SMILES

C1=CC2=C(N=C\3C(=NC=N/C3=N\C4[C@@H]([C@@H]([C@H](O4)CO)O)O)N2C=C1C(=O)O)O

InChI

InChI=1S/C16H15N5O7/c22-4-8-10(23)11(24)15(28-8)20-12-9-13(18-5-17-12)21-3-6(16(26)27)1-2-7(21)14(25)19-9/h1-3,5,8,10-11,15,22-25H,4H2,(H,26,27)/b20-12-/t8-,10-,11-,15?/m1/s1