(3S,4S,5S,6R,7S)-3,5,7-trimethylnon-1-yne-4,6-diol

Systemtic Name: (3S,4S,5S,6R,7S)-3,5,7-trimethylnon-1-yne-4,6-diol Openeye Name: (3S,4S,5S,6R,7S)-3,5,7-trimethylnon-1-yne-4,6-diol CAS Name: (3S,4S,5S,6R,7S)-3,5,7-trimethyl-1-nonyne-4,6-diol IUPAC Name: (3S,4S,5S,6R,7S)-3,5,7-trimethylnon-1-yne-4,6-diol Traditional Name: (3S,4S,5S,6R,7S)-3,5,7-trimethylnon-1-yne-4,6-diol Formula: C12H22O2 MolecularWeight: 198.30188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(C)C(C(C)C#C)O)O

Isomeric SMILES

CC[C@H](C)[C@H]([C@H](C)[C@H]([C@@H](C)C#C)O)O

InChI

InChI=1S/C12H22O2/c1-6-8(3)11(13)10(5)12(14)9(4)7-2/h1,8-14H,7H2,2-5H3/t8-,9-,10+,11-,12+/m0/s1