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5,6-Dihydrokryptogenin

View entire compound with spectra: 1 NMR

5,6-Dihydrokryptogenin
SpectraBase Compound ID 49kYfQTa0x5
InChI InChI=1S/C27H44O4/c1-16(15-28)5-8-23(30)17(2)25-24(31)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h16-22,25,28-29H,5-15H2,1-4H3
InChIKey WUCJZZPXANOCFR-UHFFFAOYSA-N
Mol Weight 432.6 g/mol
Molecular Formula C27H44O4
Exact Mass 432.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5NXJlfeTkup
Name 5,6-Dihydrokryptogenin
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 432.323959893 u
Formula C27H44O4
InChI InChI=1S/C27H44O4/c1-16(15-28)5-8-23(30)17(2)25-24(31)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h16-22,25,28-29H,5-15H2,1-4H3
InChIKey WUCJZZPXANOCFR-UHFFFAOYSA-N
Molecular Weight 432.645 g/mol
SMILES C1(CCC2(C(C1)CCC1C2CCC2(C1CC(C2C(C(=O)CCC(CO)C)C)=O)C)C)O