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9-ALPHA-ACETOXY-CUMAMBRIN-A;CONFORMER-A/B
SpectraBase Compound ID GxpnfsgBcu3
InChI InChI=1S/2C19H24O7/c2*1-8-6-7-12-13(8)15-14(9(2)18(22)26-15)16(24-10(3)20)17(19(12,5)23)25-11(4)21/h2*6,12-17,23H,2,7H2,1,3-5H3/t2*12-,13+,14+,15-,16-,17-,19+/m11/s1
InChIKey LMQZUTNAPGVUDB-FIFJFXTMSA-N
Mol Weight 728.79 g/mol
Molecular Formula C38H48O14
Exact Mass 728.304406 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 91ZA0RSbs08
Name 9-ALPHA-ACETOXY-CUMAMBRIN-A;CONFORMER-A/B
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H48O14
InChI InChI=1S/2C19H24O7/c2*1-8-6-7-12-13(8)15-14(9(2)18(22)26-15)16(24-10(3)20)17(19(12,5)23)25-11(4)21/h2*6,12-17,23H,2,7H2,1,3-5H3/t2*12-,13+,14+,15-,16-,17-,19+/m11/s1
InChIKey LMQZUTNAPGVUDB-FIFJFXTMSA-N
Literature Reference Author V.BULATOVIC,V.VAJS,S.MACURA,N.JURANIC,S.MILOSAVLJEVIC
Literature Reference Citation J.NAT.PROD.,60,1222(1997)
Literature Reference DOI 10.1021/np970185w
Molecular Weight 728.791 g/mol
Solvent CDCl3
Source File Reference UWCS23200