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NASIMALUN-B;DIMETHYL-15,16-EPOXY-3,13-(16),14-NEO-CLEODATRIEN-17,18-DICARBOXYATE;17-CARBOXYMETHYL-HARDWICKIIC-ACID-METHYLESTER

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NASIMALUN-B;DIMETHYL-15,16-EPOXY-3,13-(16),14-NEO-CLEODATRIEN-17,18-DICARBOXYATE;17-CARBOXYMETHYL-HARDWICKIIC-ACID-METHYLESTER
SpectraBase Compound ID K4SSVWJnNqU
InChI InChI=1S/C22H30O5/c1-21(11-8-15-10-13-27-14-15)17(20(24)26-4)9-12-22(2)16(19(23)25-3)6-5-7-18(21)22/h6,10,13-14,17-18H,5,7-9,11-12H2,1-4H3/t17-,18+,21-,22-/m0/s1
InChIKey UKLZKUFVLXPLCP-UDKICSLYSA-N
Mol Weight 374.48 g/mol
Molecular Formula C22H30O5
Exact Mass 374.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1eJlLm7IgTp
Name NASIMALUN-B;DIMETHYL-15,16-EPOXY-3,13-(16),14-NEO-CLEODATRIEN-17,18-DICARBOXYATE;17-CARBOXYMETHYL-HARDWICKIIC-ACID-METHYLESTER
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O5
InChI InChI=1S/C22H30O5/c1-21(11-8-15-10-13-27-14-15)17(20(24)26-4)9-12-22(2)16(19(23)25-3)6-5-7-18(21)22/h6,10,13-14,17-18H,5,7-9,11-12H2,1-4H3/t17-,18+,21-,22-/m0/s1
InChIKey UKLZKUFVLXPLCP-UDKICSLYSA-N
Literature Reference Author C.M.HASAN,S.KHAN,A.JABBAR,M.A.RASHID
Literature Reference Citation J.NAT.PROD.,63,410(2000)
Literature Reference DOI 10.1021/np990488l
Molecular Weight 374.477 g/mol
Solvent CDCl3
Source File Reference UWRU1926