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CEANOTHIC-ACID;2-ALPHA-CARBOXY-3-BETA-HYDROXY-A(1)-NORLUP-20(29)-EN-28-OIC-ACID
SpectraBase Compound ID 4dN0wVANmzC
InChI InChI=1S/C30H46O5/c1-16(2)17-10-13-30(25(34)35)15-14-27(5)18(21(17)30)8-9-20-28(27,6)12-11-19-26(3,4)23(31)22(24(32)33)29(19,20)7/h17-23,31H,1,8-15H2,2-7H3,(H,32,33)(H,34,35)/t17-,18+,19-,20-,21+,22+,23-,27+,28+,29-,30-/m0/s1
InChIKey WLCHQSHZHFLMJH-VILVJDKQSA-N
Mol Weight 486.7 g/mol
Molecular Formula C30H46O5
Exact Mass 486.334525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KzPrNeGFDy
Name CEANOTHIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46O5
InChI InChI=1S/C30H46O5/c1-16(2)17-10-13-30(25(34)35)15-14-27(5)18(21(17)30)8-9-20-28(27,6)12-11-19-26(3,4)23(31)22(24(32)33)29(19,20)7/h17-23,31H,1,8-15H2,2-7H3,(H,32,33)(H,34,35)/t17-,18+,19-,20-,21+,22+,23-,27+,28+,29-,30-/m0/s1
InChIKey WLCHQSHZHFLMJH-VILVJDKQSA-N
Literature Reference Author S.S.LEE,W.C.SU,K.C.LIU
Literature Reference Citation J.NAT.PROD.,54,615(1991)
Literature Reference DOI 10.1021/np50074a047
Molecular Weight 486.692 g/mol
Solvent PYRIDINE-D5
Source File Reference UWTS287