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Licorisoflavan A, 2ac derivative

View entire compound with spectra: 1 NMR

Licorisoflavan A, 2ac derivative
SpectraBase Compound ID FZbs0Dxqw43
InChI InChI=1S/C31H38O7/c1-18(2)9-11-24-27(37-20(5)32)14-13-23(31(24)38-21(6)33)22-15-26-29(36-17-22)16-28(34-7)25(30(26)35-8)12-10-19(3)4/h9-10,13-14,16,22H,11-12,15,17H2,1-8H3/t22-/m0/s1
InChIKey VOLDDNRHVIOLHE-QFIPXVFZSA-N
Mol Weight 522.6 g/mol
Molecular Formula C31H38O7
Exact Mass 522.261754 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IsejqnMgOfg
Name Licorisoflavan A, 2ac derivative
Comments Computed using HOSE algorithm
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Exact Mass 522.261753557 u
Formula C31H38O7
InChI InChI=1S/C31H38O7/c1-18(2)9-11-24-27(37-20(5)32)14-13-23(31(24)38-21(6)33)22-15-26-29(36-17-22)16-28(34-7)25(30(26)35-8)12-10-19(3)4/h9-10,13-14,16,22H,11-12,15,17H2,1-8H3/t22-/m0/s1
InChIKey VOLDDNRHVIOLHE-QFIPXVFZSA-N
Molecular Weight 522.638 g/mol
SMILES C1[C@](CC2=C(O1)C=C(C(=C2OC)CC=C(C)C)OC)(C1=CC=C(OC(C)=O)C(CC=C(C)C)=C1OC(C)=O)[H]