3-[4-[2-[2,3-bis(oxidanyl)propyl]cyclopropyl]butyl]-1-[(2R,4R,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 3-[4-[2-[2,3-bis(oxidanyl)propyl]cyclopropyl]butyl]-1-[(2R,4R,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 3-[4-[2-(2,3-dihydroxypropyl)cyclopropyl]butyl]-1-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 3-[4-[2-(2,3-dihydroxypropyl)cyclopropyl]butyl]-1-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 3-[4-[2-(2,3-dihydroxypropyl)cyclopropyl]butyl]-1-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 3-[4-(2-glycerylcyclopropyl)butyl]-1-[(2R,4R,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone Formula: C20H32N2O7 MolecularWeight: 412.47728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)N(C1=O)CCCCC2CC2CC(CO)O)C3CC(C(O3)CO)O

Isomeric SMILES

CC1=CN(C(=O)N(C1=O)CCCCC2CC2CC(CO)O)[C@H]3C[C@H]([C@H](O3)CO)O

InChI

InChI=1S/C20H32N2O7/c1-12-9-22(18-8-16(26)17(11-24)29-18)20(28)21(19(12)27)5-3-2-4-13-6-14(13)7-15(25)10-23/h9,13-18,23-26H,2-8,10-11H2,1H3/t13?,14?,15?,16-,17-,18-/m1/s1