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PROTOESCIGENIN
SpectraBase Compound ID DODqpm08UqU
InChI InChI=1S/C30H50O6/c1-25(2)13-18-17-7-8-20-26(3)11-10-21(33)27(4,15-31)19(26)9-12-28(20,5)29(17,6)14-22(34)30(18,16-32)24(36)23(25)35/h7,18-24,31-36H,8-16H2,1-6H3/t18-,19+,20+,21-,22+,23-,24-,26-,27+,28+,29+,30-/m0/s1
InChIKey VKJLHZZPVLQJKG-JAGYOTNFSA-N
Mol Weight 506.7 g/mol
Molecular Formula C30H50O6
Exact Mass 506.360739 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GKcoYWgx6fT
Name PROTOAESCIGENIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H50O6
InChI InChI=1S/C30H50O6/c1-25(2)13-18-17-7-8-20-26(3)11-10-21(33)27(4,15-31)19(26)9-12-28(20,5)29(17,6)14-22(34)30(18,16-32)24(36)23(25)35/h7,18-24,31-36H,8-16H2,1-6H3/t18-,19+,20+,21-,22+,23-,24-,26-,27+,28+,29+,30-/m0/s1
InChIKey VKJLHZZPVLQJKG-JAGYOTNFSA-N
Literature Reference Author P.K.AGRAWAL,R.S.THAKUR,J.N.SHOOLERY
Literature Reference Citation J.NAT.PROD.,54,1394(1991)
Literature Reference DOI 10.1021/np50077a025
Molecular Weight 506.723 g/mol
Solvent PYRIDINE-D5
Source File Reference UWTS866