2-(hydroxymethyl)-2-[2-methanoyl-1,4-bis(oxidanyl)pentan-2-yl]oxy-4-oxidanyl-pentanal

Systemtic Name: 2-(hydroxymethyl)-2-[2-methanoyl-1,4-bis(oxidanyl)pentan-2-yl]oxy-4-oxidanyl-pentanal Openeye Name: 2-[1-formyl-3-hydroxy-1-(hydroxymethyl)butoxy]-4-hydroxy-2-(hydroxymethyl)pentanal CAS Name: 2-(2-formyl-1,4-dihydroxypentan-2-yl)oxy-4-hydroxy-2-(hydroxymethyl)pentanal IUPAC Name: 2-(2-formyl-1,4-dihydroxypentan-2-yl)oxy-4-hydroxy-2-(hydroxymethyl)pentanal Traditional Name: 2-(1-formyl-3-hydroxy-1-methylol-butoxy)-4-hydroxy-2-methylol-valeraldehyde Formula: C12H22O7 MolecularWeight: 278.29888

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CO)(C=O)OC(CC(C)O)(CO)C=O)O

Isomeric SMILES

CC(CC(CO)(C=O)OC(CC(C)O)(CO)C=O)O

InChI

InChI=1S/C12H22O7/c1-9(17)3-11(5-13,6-14)19-12(7-15,8-16)4-10(2)18/h5,7,9-10,14,16-18H,3-4,6,8H2,1-2H3