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Dimethyl 12,12'-dimethoxy-13,13'-bi(podocarpa-8,11,13-trien-19-oate

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Dimethyl 12,12'-dimethoxy-13,13'-bi(podocarpa-8,11,13-trien-19-oate
SpectraBase Compound ID Ed1eLqzAwjf
InChI InChI=1S/C38H50O6/c1-35-15-9-17-37(3,33(39)43-7)31(35)13-11-23-19-25(29(41-5)21-27(23)35)26-20-24-12-14-32-36(2,28(24)22-30(26)42-6)16-10-18-38(32,4)34(40)44-8/h19-22,31-32H,9-18H2,1-8H3/t31?,32?,35-,36-,37+,38+/m1/s1
InChIKey DZJUCDZRRBUROI-JLKVKXMGSA-N
Mol Weight 602.8 g/mol
Molecular Formula C38H50O6
Exact Mass 602.360739 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FqGokf5soUn
Name Dimethyl 12,12'-dimethoxy-13,13'-bi(podocarpa-8,11,13-trien-19-oate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 602.360739324 u
Formula C38H50O6
InChI InChI=1S/C38H50O6/c1-35-15-9-17-37(3,33(39)43-7)31(35)13-11-23-19-25(29(41-5)21-27(23)35)26-20-24-12-14-32-36(2,28(24)22-30(26)42-6)16-10-18-38(32,4)34(40)44-8/h19-22,31-32H,9-18H2,1-8H3/t31?,32?,35-,36-,37+,38+/m1/s1
InChIKey DZJUCDZRRBUROI-JLKVKXMGSA-N
Molecular Weight 602.812 g/mol
SMILES [C@]12(C3=C(C=C(C=4C=C5CCC6[C@@](C5=CC4OC)(CCC[C@@]6(C(=O)OC)C)C)C(=C3)OC)CCC1[C@](C(=O)OC)(C)CCC2)C