10-[2,2-bis(hydroxymethyl)-3-oxidanyl-propyl]-10-(9-oxidanyl-9-oxidanylidene-nonyl)nonadecanedioic acid

Systemtic Name: 10-[2,2-bis(hydroxymethyl)-3-oxidanyl-propyl]-10-(9-oxidanyl-9-oxidanylidene-nonyl)nonadecanedioic acid Openeye Name: 10-[3-hydroxy-2,2-bis(hydroxymethyl)propyl]-10-(9-hydroxy-9-oxo-nonyl)nonadecanedioic acid CAS Name: 10-[3-hydroxy-2,2-bis(hydroxymethyl)propyl]-10-(9-hydroxy-9-oxononyl)nonadecanedioic acid IUPAC Name: 10-[3-hydroxy-2,2-bis(hydroxymethyl)propyl]-10-(9-hydroxy-9-oxononyl)nonadecanedioic acid Traditional Name: 10-(3-hydroxy-2,2-dimethylol-propyl)-10-(9-hydroxy-9-keto-nonyl)nonadecanedioic acid Formula: C33H62O9 MolecularWeight: 602.83998

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCC(CCCCCCCCC(=O)O)(CCCCCCCCC(=O)O)CC(CO)(CO)CO)CCCC(=O)O

Isomeric SMILES

C(CCCCC(CCCCCCCCC(=O)O)(CCCCCCCCC(=O)O)CC(CO)(CO)CO)CCCC(=O)O

InChI

InChI=1S/C33H62O9/c34-26-33(27-35,28-36)25-32(22-16-10-4-1-7-13-19-29(37)38,23-17-11-5-2-8-14-20-30(39)40)24-18-12-6-3-9-15-21-31(41)42/h34-36H,1-28H2,(H,37,38)(H,39,40)(H,41,42)