(3S,4R,7S)-7-methoxy-2,2,4-trimethyl-3-oxidanyl-decanoic acid

Systemtic Name: (3S,4R,7S)-7-methoxy-2,2,4-trimethyl-3-oxidanyl-decanoic acid Openeye Name: (3S,4R,7S)-3-hydroxy-7-methoxy-2,2,4-trimethyl-decanoic acid CAS Name: (3S,4R,7S)-3-hydroxy-7-methoxy-2,2,4-trimethyldecanoic acid IUPAC Name: (3S,4R,7S)-3-hydroxy-7-methoxy-2,2,4-trimethyldecanoic acid Traditional Name: (3S,4R,7S)-3-hydroxy-7-methoxy-2,2,4-trimethyl-capric acid Formula: C14H28O4 MolecularWeight: 260.36972

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC(C)C(C(C)(C)C(=O)O)O)OC

Isomeric SMILES

CCC[C@@H](CC[C@@H](C)[C@@H](C(C)(C)C(=O)O)O)OC

InChI

InChI=1S/C14H28O4/c1-6-7-11(18-5)9-8-10(2)12(15)14(3,4)13(16)17/h10-12,15H,6-9H2,1-5H3,(H,16,17)/t10-,11+,12+/m1/s1