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(2R,3S,4S,5R,6R)-2-(Hydroxymethyl)-6-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)oxyoxane-3,4,5-triol, 4me derivative
SpectraBase Compound ID EahtHB1gY2a
InChI InChI=1S/C20H34O6/c1-12(2)14-9-8-13(3)15(10-14)25-20-19(24-7)18(23-6)17(22-5)16(26-20)11-21-4/h8,14-20H,1,9-11H2,2-7H3/t14?,15?,16-,17-,18+,19-,20-/m1/s1
InChIKey DHRIZWVSCKNZBQ-SPCAHAMJSA-N
Mol Weight 370.5 g/mol
Molecular Formula C20H34O6
Exact Mass 370.235539 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 23YxHnJg3HW
Name (2R,3S,4S,5R,6R)-2-(Hydroxymethyl)-6-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)oxyoxane-3,4,5-triol, 4me derivative
Comments Computed using HOSE algorithm
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Exact Mass 370.235538809 u
Formula C20H34O6
InChI InChI=1S/C20H34O6/c1-12(2)14-9-8-13(3)15(10-14)25-20-19(24-7)18(23-6)17(22-5)16(26-20)11-21-4/h8,14-20H,1,9-11H2,2-7H3/t14?,15?,16-,17-,18+,19-,20-/m1/s1
InChIKey DHRIZWVSCKNZBQ-SPCAHAMJSA-N
Molecular Weight 370.486 g/mol
SMILES C1(CC(CC=C1C)C(C)=C)O[C@@]1(O[C@@]([C@]([C@@]([C@]1(OC)[H])(OC)[H])(OC)[H])(COC)[H])[H]