(3aR,5R,6R,7S,7aS)-4-butyl-5-(hydroxymethyl)-6,7-bis(oxidanyl)-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridin-2-one

Systemtic Name: (3aR,5R,6R,7S,7aS)-4-butyl-5-(hydroxymethyl)-6,7-bis(oxidanyl)-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridin-2-one Openeye Name: (3aR,5R,6R,7S,7aS)-4-butyl-6,7-dihydroxy-5-(hydroxymethyl)-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridin-2-one CAS Name: (3aR,5R,6R,7S,7aS)-4-butyl-6,7-dihydroxy-5-(hydroxymethyl)-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridin-2-one IUPAC Name: (3aR,5R,6R,7S,7aS)-4-butyl-6,7-dihydroxy-5-(hydroxymethyl)-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridin-2-one Traditional Name: (3aR,5R,6R,7S,7aS)-4-butyl-6,7-dihydroxy-5-methylol-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridin-2-one Formula: C12H21NO5 MolecularWeight: 259.29884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2CC(=O)OC2C(C(C1CO)O)O

Isomeric SMILES

CCCCN1[C@@H]2CC(=O)O[C@@H]2[C@H]([C@@H]([C@H]1CO)O)O

InChI

InChI=1S/C12H21NO5/c1-2-3-4-13-7-5-9(15)18-12(7)11(17)10(16)8(13)6-14/h7-8,10-12,14,16-17H,2-6H2,1H3/t7-,8-,10-,11+,12+/m1/s1