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11,19-Dihydroxyabieta-5,7,9(11),13-tetraen-12-one, 19-o-p-hydroxybenzoate

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11,19-Dihydroxyabieta-5,7,9(11),13-tetraen-12-one, 19-o-p-hydroxybenzoate
SpectraBase Compound ID 4oaOrM6ejH6
InChI InChI=1S/C27H30O5/c1-16(15-32-25(31)17-6-9-19(28)10-7-17)20-14-18-8-11-21-26(2,3)12-5-13-27(21,4)22(18)24(30)23(20)29/h6-11,14,16,28,30H,5,12-13,15H2,1-4H3
InChIKey QKGPFAIUDPSGKK-UHFFFAOYSA-N
Mol Weight 434.53 g/mol
Molecular Formula C27H30O5
Exact Mass 434.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1K5kZ7LQpH6
Name 11,19-Dihydroxyabieta-5,7,9(11),13-tetraen-12-one, 19-o-p-hydroxybenzoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.209324061 u
Formula C27H30O5
InChI InChI=1S/C27H30O5/c1-16(15-32-25(31)17-6-9-19(28)10-7-17)20-14-18-8-11-21-26(2,3)12-5-13-27(21,4)22(18)24(30)23(20)29/h6-11,14,16,28,30H,5,12-13,15H2,1-4H3
InChIKey QKGPFAIUDPSGKK-UHFFFAOYSA-N
Molecular Weight 434.532 g/mol
SMILES C1CCC2(C(C1(C)C)=CC=C1C2=C(C(=O)C(=C1)C(C)COC(=O)C1=CC=C(O)C=C1)O)C