(1R,2S,3S,6S)-1,5,5-trimethyl-6-[(E,3S)-3-oxidanylbut-1-enyl]-7-oxabicyclo[4.1.0]heptane-2,3-diol

Systemtic Name: (1R,2S,3S,6S)-1,5,5-trimethyl-6-[(E,3S)-3-oxidanylbut-1-enyl]-7-oxabicyclo[4.1.0]heptane-2,3-diol Openeye Name: (1R,2S,3S,6S)-6-[(E,3S)-3-hydroxybut-1-enyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptane-2,3-diol CAS Name: (1R,2S,3S,6S)-6-[(E,3S)-3-hydroxybut-1-enyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptane-2,3-diol IUPAC Name: (1R,2S,3S,6S)-6-[(E,3S)-3-hydroxybut-1-enyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptane-2,3-diol Traditional Name: (1R,2S,3S,6S)-6-[(E,3S)-3-hydroxybut-1-enyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptane-2,3-diol Formula: C13H22O4 MolecularWeight: 242.31138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CC12C(CC(C(C1(O2)C)O)O)(C)C)O

Isomeric SMILES

C[C@@H](/C=C/[C@]12[C@](O1)([C@H]([C@H](CC2(C)C)O)O)C)O

InChI

InChI=1S/C13H22O4/c1-8(14)5-6-13-11(2,3)7-9(15)10(16)12(13,4)17-13/h5-6,8-10,14-16H,7H2,1-4H3/b6-5+/t8-,9-,10-,12+,13-/m0/s1