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(2E,6S)-6-[(1R,5Z,3AS,9R,10Z,12AR)-1,2,3,3A,4,7,8,9,12,12A-DECAHYDRO-9-HYDROXY-3A,6,10-TRIMETHYLCYCLOPENTANOCYCLOUNDECEN-1-YL]-2-METHYLHEPT-

Compound with spectra: 1 NMR, and 1 MS (GC)

(2E,6S)-6-[(1R,5Z,3AS,9R,10Z,12AR)-1,2,3,3A,4,7,8,9,12,12A-DECAHYDRO-9-HYDROXY-3A,6,10-TRIMETHYLCYCLOPENTANOCYCLOUNDECEN-1-YL]-2-METHYLHEPT-
SpectraBase Compound ID A7NoCR0h9uq
InChI InChI=1S/C25H40O3/c1-17-9-12-23(26)19(3)10-11-22-21(14-16-25(22,5)15-13-17)18(2)7-6-8-20(4)24(27)28/h8,10,13,18,21-23,26H,6-7,9,11-12,14-16H2,1-5H3,(H,27,28)/b17-13-,19-10-,20-8+/t18-,21+,22+,23+,25+/m0/s1
InChIKey BSSJWMDJGNMFKS-JUBNQSSJSA-N
Mol Weight 388.6 g/mol
Molecular Formula C25H40O3
Exact Mass 388.297745 g/mol
Enantiomer InChIKey BSSJWMDJGNMFKS-SILWEHEHSA-N

View Spectrum of (2E,6S)-6-[(1R,5Z,3AS,9R,10Z,12AR)-1,2,3,3A,4,7,8,9,12,12A-DECAHYDRO-9-HYDROXY-3A,6,10-TRIMETHYLCYCLOPENTANOCYCLOUNDECEN-1-YL]-2-METHYLHEPT-

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum G4-65-1752-2

View Spectrum of (2E,6S)-6-[(1R,5Z,3AS,9R,10Z,12AR)-1,2,3,3A,4,7,8,9,12,12A-DECAHYDRO-9-HYDROXY-3A,6,10-TRIMETHYLCYCLOPENTANOCYCLOUNDECEN-1-YL]-2-METHYLHEPT-

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • (2E,6S)-6-[(1R,5Z,3aS,9R,10Z,12aR)-1,2,3,3a,4,7,8,9,12,12a-decahydro-9-hydroxy-3a,6,10-trimethylcyclopentanocycloundecen-1-yl]-2-methylhept-2-enoic acid
(1-R,3-E,7-E,9-S,11-S,12-R)-DOLABELLA-3,7,18-TRIEN-9-OL
Bicyclo[7.2.0]undec-6-ene-10-ethanol, 5-hydroxy-6,10-dimethyl-2-methylene-.alpha.-(2-methyl-1-propenyl)-
(1-R,3-E,7-E,11-S,12-R)-DOLABELLA-3,7,18-TRIEN-9-ONE
DAUCA-3,11-DIEN-2-ALPHA,15-DIOL
(8R)-DE-A,B-CHOLEST-14-EN-8-OL;(VITAMIN-D-DERIVATIVE)
(1R,3E,7E,11R,12R)-12-Hydroxy-3,7-dolabelladiene
(1R,5S)-Ethyl 1-Isopropyl-4-methylenespiro[4.5]dec-7-ene-8-carboxylate
(1aR,4aS,7R,7aR,7bS)-1,1,4,7-tetramethyl-1a,2,4a,5,6,7,7a,7b-octahydrocyclopropa[e]azulene
3H-Benz[e]inden-3-one, dodecahydro-3a-methyl-, (3a.alpha.,5a.alpha.,9a.beta.,9b.alpha.)-
3H-Benz[e]inden-3-one, dodecahydro-3a-methyl-, (3a.alpha.,5a.beta.,9a.alpha.,9b.beta.)-
Title Journal or Book Year
Isolation and Structure Elucidation of an Isoflavone and a Sesterterpenoic Acid from Henriettella fascicularis Journal of Natural Products 2002
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