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CALLYSPONGIN-B
SpectraBase Compound ID Ijv9HYQumwC
InChI InChI=1S/C23H24O5S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(24)22-28-29(25,26)27;/h1,3-4,9-10,23-24H,5-8,15-17,22H2,(H,25,26,27);/q;+1/p-1/b4-3-,10-9-;
InChIKey HAQWGOPBJHUBGO-KYPNLQGTSA-M
Mol Weight 434.48 g/mol
Molecular Formula C23H23NaO5S
Exact Mass 434.116389 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Ml77dTssaz
Name CALLYSPONGIN-B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H23NaO5S
InChI InChI=1S/C23H24O5S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(24)22-28-29(25,26)27;/h1,3-4,9-10,23-24H,5-8,15-17,22H2,(H,25,26,27);/q;+1/p-1/b4-3-,10-9-;
InChIKey HAQWGOPBJHUBGO-KYPNLQGTSA-M
Literature Reference Author M.UNO,S.OHTA,E.OHTA,S.IKEGAMI
Literature Reference Citation J.NAT.PROD.,59,1146(1996)
Literature Reference DOI 10.1021/np960516p
Molecular Weight 434.482 g/mol
Solvent DMSO-D6
Source File Reference UWKP56