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(2S,3Z,3aS,5aR,7S,9aR,9bS)-3-[(3E,5E,7S)-7-hydroxy-6,10-dimethylundeca-3,5,9-trien-2-ylidene]-3a,6,6,9a-tetramethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[g]indene-2,7-diol

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(2S,3Z,3aS,5aR,7S,9aR,9bS)-3-[(3E,5E,7S)-7-hydroxy-6,10-dimethylundeca-3,5,9-trien-2-ylidene]-3a,6,6,9a-tetramethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[g]indene-2,7-diol
SpectraBase Compound ID 1e7mZn3lbhe
InChI InChI=1S/C30H48O3/c1-19(2)12-13-22(31)20(3)10-9-11-21(4)27-23(32)18-25-29(7)17-15-26(33)28(5,6)24(29)14-16-30(25,27)8/h9-12,22-26,31-33H,13-18H2,1-8H3/b11-9+,20-10+,27-21+/t22-,23-,24-,25-,26-,29-,30-/m0/s1
InChIKey ULXATCSLZGBUIT-UMFNYLICSA-N
Mol Weight 456.7 g/mol
Molecular Formula C30H48O3
Exact Mass 456.360345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B0AgRZJFW2v
Name (2S,3Z,3aS,5aR,7S,9aR,9bS)-3-[(3E,5E,7S)-7-hydroxy-6,10-dimethylundeca-3,5,9-trien-2-ylidene]-3a,6,6,9a-tetramethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[g]indene-2,7-diol
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O3
InChI InChI=1S/C30H48O3/c1-19(2)12-13-22(31)20(3)10-9-11-21(4)27-23(32)18-25-29(7)17-15-26(33)28(5,6)24(29)14-16-30(25,27)8/h9-12,22-26,31-33H,13-18H2,1-8H3/b11-9+,20-10+,27-21+/t22-,23-,24-,25-,26-,29-,30-/m0/s1
InChIKey ULXATCSLZGBUIT-UMFNYLICSA-N
Literature Reference Author N.OKU,S.MATSUNAGA,S.I.WADA,S.WATABE,N.FUSETANI
Literature Reference Citation J.NAT.PROD.,63,205(2000)
Literature Reference DOI 10.1021/np990333d
Molecular Weight 456.709 g/mol
Solvent C6D6
Source File Reference UWGE6163