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SCOPARIC-ACID-C;6-BENZOYL-15-NOR-14-OXO-8(17)-LABDAN-18-OIC-ACID
SpectraBase Compound ID CMAhjD3CF49
InChI InChI=1S/C26H32O5/c1-17(16-27)11-12-20-18(2)15-21(31-23(28)19-9-6-5-7-10-19)22-25(20,3)13-8-14-26(22,4)24(29)30/h5-7,9-10,16,20-22H,1-2,8,11-15H2,3-4H3,(H,29,30)/t20-,21-,22?,25-,26-/m1/s1
InChIKey NTDJBAOUNYDJKY-XDPLYILSSA-N
Mol Weight 424.5 g/mol
Molecular Formula C26H32O5
Exact Mass 424.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KgHw0cX3Wwy
Name SCOPARIC-ACID-C;6-BENZOYL-15-NOR-14-OXO-8(17)-LABDAN-18-OIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H32O5
InChI InChI=1S/C26H32O5/c1-17(16-27)11-12-20-18(2)15-21(31-23(28)19-9-6-5-7-10-19)22-25(20,3)13-8-14-26(22,4)24(29)30/h5-7,9-10,16,20-22H,1-2,8,11-15H2,3-4H3,(H,29,30)/t20-,21-,22?,25-,26-/m1/s1
InChIKey NTDJBAOUNYDJKY-XDPLYILSSA-N
Literature Reference Author T.HAYASHI,M.KAWASAKI,K.OKAMURA,Y.TAMADA,N.MORITA,Y.TEZUKA,T. KIKUCHI,Y.MIWA,T.TAG
Literature Reference Citation J.NAT.PROD.,55,1748(1992)
Literature Reference DOI 10.1021/np50090a005
Molecular Weight 424.537 g/mol
Solvent CDCl3
Source File Reference UWCS3301