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21-KETOGAMMACERAN-3-ALPHA-ACETATE
SpectraBase Compound ID 8sN3Yxo17tm
InChI InChI=1S/C32H52O3/c1-20(33)35-26-15-17-30(7)22(28(26,4)5)13-19-32(9)24(30)11-10-23-29(6)16-14-25(34)27(2,3)21(29)12-18-31(23,32)8/h21-24,26H,10-19H2,1-9H3/t21-,22?,23+,24?,26+,29-,30-,31+,32+/m0/s1
InChIKey HQLYWXFVTPVCNF-XSNZGWCPSA-N
Mol Weight 484.8 g/mol
Molecular Formula C32H52O3
Exact Mass 484.391646 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BlLM80Sji4A
Name 21-KETOGAMMACERAN-3-ALPHA-ACETATE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H52O3
InChI InChI=1S/C32H52O3/c1-20(33)35-26-15-17-30(7)22(28(26,4)5)13-19-32(9)24(30)11-10-23-29(6)16-14-25(34)27(2,3)21(29)12-18-31(23,32)8/h21-24,26H,10-19H2,1-9H3/t21-,22?,23+,24?,26+,29-,30-,31+,32+/m0/s1
InChIKey HQLYWXFVTPVCNF-XSNZGWCPSA-N
Literature Reference Author R.TANAKA,T.MIZOTA,S.MATSUNAGA
Literature Reference Citation J.NAT.PROD.,57,761(1994)
Literature Reference DOI 10.1021/np50108a012
Molecular Weight 484.763 g/mol
Solvent CDCl3
Source File Reference UWTS1854