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CSECYHNWAWCJBQ-HUMFMXAESA-N
SpectraBase Compound ID 4kCq7rcDWl4
InChI InChI=1S/C25H36O5/c1-6-15(2)20(26)30-19-16(3)17-8-13-25(29)23(5)11-7-10-22(4,21(27)28)18(23)9-12-24(19,25)14-17/h6,17-19,29H,3,7-14H2,1-2,4-5H3,(H,27,28)/b15-6+/t17-,18-,19+,22-,23-,24+,25-/m1/s1
InChIKey CSECYHNWAWCJBQ-HUMFMXAESA-N
Mol Weight 416.6 g/mol
Molecular Formula C25H36O5
Exact Mass 416.256274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bmi4pmqpGjA
Name 15-alpha-TIGLOYLOXY-9-beta-HYDROXY-ENT-KAUR-16-EN-19-OIC ACID
Comments according to structure Tigloyl, according to shift values ????;WR,6.2.2001
Compound Number 362
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H36O5/c1-6-15(2)20(26)30-19-16(3)17-8-13-25(29)23(5)11-7-10-22(4,21(27)28)18(23)9-12-24(19,25)14-17/h6,17-19,29H,3,7-14H2,1-2,4-5H3,(H,27,28)/b15-6+/t17-,18-,19+,22-,23-,24+,25-/m1/s1
InChIKey CSECYHNWAWCJBQ-HUMFMXAESA-N
Literature Reference A.UR-RAHMAN,V.U.AHMAD NAT.PROD.VOL.2
Solvent Chloroform-d