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(8R,3'S or 8S,3'R)-lancifolin C
SpectraBase Compound ID 43T5Md3YuSz
InChI InChI=1S/C22H28O5/c1-7-8-17-14-22(27-6,21(26-5)13-18(17)23)15(2)11-16-9-10-19(24-3)20(12-16)25-4/h7,9-10,12-15H,1,8,11H2,2-6H3/t15-,22-/m1/s1
InChIKey MVOMQPWLJRZYDT-IVZQSRNASA-N
Mol Weight 372.46 g/mol
Molecular Formula C22H28O5
Exact Mass 372.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AcedeVF8Hzl
Name (8R,3'S or 8S,3'R)-Lancifolin C
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 372.193673997 u
Formula C22H28O5
InChI InChI=1S/C22H28O5/c1-7-8-17-14-22(27-6,21(26-5)13-18(17)23)15(2)11-16-9-10-19(24-3)20(12-16)25-4/h7,9-10,12-15H,1,8,11H2,2-6H3/t15-,22-/m1/s1
InChIKey MVOMQPWLJRZYDT-IVZQSRNASA-N
Molecular Weight 372.461 g/mol
SMILES C1(=C(C=CC(C[C@]([C@]2(C(=CC(=O)C(CC=C)=C2)OC)OC)(C)[H])=C1)OC)OC