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(1S,5S,6R,7R)-7-Hydroxy-6-[(E,4S)-4-hydroxy-4-methyl-1-octenyl]-3-[2-(4-methoxycarbonylphenyl)ethyl]bicyclo[3.3.0]-2-octene

View entire compound with spectra: 1 MS (GC)

(1S,5S,6R,7R)-7-Hydroxy-6-[(E,4S)-4-hydroxy-4-methyl-1-octenyl]-3-[2-(4-methoxycarbonylphenyl)ethyl]bicyclo[3.3.0]-2-octene
SpectraBase Compound ID Br8TNKfGiT7
InChI InChI=1S/C27H38O4/c1-4-5-14-27(2,30)15-6-7-23-24-17-20(16-22(24)18-25(23)28)9-8-19-10-12-21(13-11-19)26(29)31-3/h6-7,10-13,16,22-25,28,30H,4-5,8-9,14-15,17-18H2,1-3H3/b7-6+/t22-,23+,24-,25+,27-/m0/s1
InChIKey FSASGRVDKNXBOD-XXWOYHMVSA-N
Mol Weight 426.6 g/mol
Molecular Formula C27H38O4
Exact Mass 426.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IKRwWoU5Cbq
Name (1S,5S,6R,7R)-7-Hydroxy-6-[(E,4S)-4-hydroxy-4-methyl-1-octenyl]-3-[2-(4-methoxycarbonylphenyl)ethyl]bicyclo[3.3.0]-2-octene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H38O4
InChI InChI=1S/C27H38O4/c1-4-5-14-27(2,30)15-6-7-23-24-17-20(16-22(24)18-25(23)28)9-8-19-10-12-21(13-11-19)26(29)31-3/h6-7,10-13,16,22-25,28,30H,4-5,8-9,14-15,17-18H2,1-3H3/b7-6+/t22-,23+,24-,25+,27-/m0/s1
InChIKey FSASGRVDKNXBOD-XXWOYHMVSA-N
Molecular Weight 426.597 g/mol
SMILES O[C@](C\C=C\[C@@]1([C@@]2([C@](C[C@]1(O)[H])(C=C(C2)CCc1ccc(C(=O)OC)cc1)[H])[H])[H])(CCCC)C
SPLASH splash10-0a4i-0609100000-6959f028d1eda4390f4d
Source of Spectrum F-51-5539-14c
Wiley ID 791932