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CARDIVIN-C;2,10-DIHYDROXY-5-OXO-6-(ISOBUTYLOXY)-9-(ANGELOYLOXY)-GERMACRAN-8,12-OLIDE
SpectraBase Compound ID 74ctbpevF9v
InChI InChI=1S/C24H34O9/c1-8-12(4)22(28)33-20-19-16(14(6)23(29)32-19)18(31-21(27)11(2)3)17(26)13(5)9-15(25)10-24(20,7)30/h8,11,13,15-16,18-20,25,30H,6,9-10H2,1-5,7H3/b12-8-/t13-,15-,16-,18-,19+,20-,24+/m1/s1
InChIKey XWZYMNOGYGCQNQ-JLRVPPRNSA-N
Mol Weight 466.5 g/mol
Molecular Formula C24H34O9
Exact Mass 466.220283 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3xXH3cxAh6O
Name CARDIVIN-C;2,10-DIHYDROXY-5-OXO-6-(ISOBUTYLOXY)-9-(ANGELOYLOXY)-GERMACRAN-8,12-OLIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H34O9
InChI InChI=1S/C24H34O9/c1-8-12(4)22(28)33-20-19-16(14(6)23(29)32-19)18(31-21(27)11(2)3)17(26)13(5)9-15(25)10-24(20,7)30/h8,11,13,15-16,18-20,25,30H,6,9-10H2,1-5,7H3/b12-8-/t13-,15-,16-,18-,19+,20-,24+/m1/s1
InChIKey XWZYMNOGYGCQNQ-JLRVPPRNSA-N
Literature Reference Author D.K.KIM,N.I.BAEK,S.U.CHOI,C.O.LEE,K.R.LEE,O.P.ZEE
Literature Reference Citation J.NAT.PROD.,60,1199(1997)
Literature Reference DOI 10.1021/np970157d
Molecular Weight 466.529 g/mol
Solvent CDCl3
Source File Reference WANG579