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19-NORERGOSTA-5,7,9,24(28)-TETRAEN-3-BETA-OL

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19-NORERGOSTA-5,7,9,24(28)-TETRAEN-3-BETA-OL
SpectraBase Compound ID ALDBNqnrxJN
InChI InChI=1S/C27H40O/c1-17(2)18(3)6-7-19(4)25-12-13-26-24-10-8-20-16-21(28)9-11-22(20)23(24)14-15-27(25,26)5/h8,10,17,19,21,25-26,28H,3,6-7,9,11-16H2,1-2,4-5H3/t19-,21+,25-,26+,27-/m1/s1
InChIKey KDPTUANESCCNQL-QBRUDOHGSA-N
Mol Weight 380.6 g/mol
Molecular Formula C27H40O
Exact Mass 380.307916 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B2xdejOC49
Name 19-NORERGOSTA-5,7,9,24(28)-TETRAEN-3-BETA-OL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H40O
InChI InChI=1S/C27H40O/c1-17(2)18(3)6-7-19(4)25-12-13-26-24-10-8-20-16-21(28)9-11-22(20)23(24)14-15-27(25,26)5/h8,10,17,19,21,25-26,28H,3,6-7,9,11-16H2,1-2,4-5H3/t19-,21+,25-,26+,27-/m1/s1
InChIKey KDPTUANESCCNQL-QBRUDOHGSA-N
Literature Reference Author A.F.BARRERO,J.E.OLTRA,J.A.POYATOS,D.JIMENEZ,E.OLIVER
Literature Reference Citation J.NAT.PROD.,61,1491(1998)
Literature Reference DOI 10.1021/np980199h
Molecular Weight 380.614 g/mol
Solvent CDCl3
Source File Reference UWGE1154