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(6-alpha,8-alpha,13R)-Labd-14-ene-6,8,13,18-tetrol
SpectraBase Compound ID F7P5Tdt6bjW
InChI InChI=1S/C20H36O4/c1-6-18(3,23)11-8-15-19(4)10-7-9-17(2,13-21)16(19)14(22)12-20(15,5)24/h6,14-16,21-24H,1,7-13H2,2-5H3/t14-,15+,16-,17-,18-,19+,20+/m0/s1
InChIKey MPWPDFHNMIZJFZ-QTCMIBMWSA-N
Mol Weight 340.5 g/mol
Molecular Formula C20H36O4
Exact Mass 340.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 87p9C3dtGz5
Name (6-alpha,8-alpha,13R)-Labd-14-ene-6,8,13,18-tetrol
Comments Computed using HOSE algorithm
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Exact Mass 340.261359635 u
Formula C20H36O4
InChI InChI=1S/C20H36O4/c1-6-18(3,23)11-8-15-19(4)10-7-9-17(2,13-21)16(19)14(22)12-20(15,5)24/h6,14-16,21-24H,1,7-13H2,2-5H3/t14-,15+,16-,17-,18-,19+,20+/m0/s1
InChIKey MPWPDFHNMIZJFZ-QTCMIBMWSA-N
Molecular Weight 340.504 g/mol
SMILES C1C[C@](C)([C@]2([H])[C@](C[C@@](C)(O)[C@](CC[C@@](C=C)(C)O)([C@@]2(C)C1)[H])(O)[H])CO