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(9R,11R,14RS)-8,14-diacetoxy-9,11-epoxy-17-nor-8,9-secolabdan-13-ol
SpectraBase Compound ID ET0LbzafuWg
InChI InChI=1S/C23H40O6/c1-15(28-17(3)25)23(7,26)14-18-20(29-18)22(6)12-9-11-21(4,5)19(22)10-8-13-27-16(2)24/h15,18-20,26H,8-14H2,1-7H3/t15?,18-,19+,20+,22+,23-/m1/s1
InChIKey WXRKYKLOHHFSFG-UIJQDGBFSA-N
Mol Weight 412.6 g/mol
Molecular Formula C23H40O6
Exact Mass 412.282489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2iXY4g0kaK1
Name (9R,11R,14RS)-8,14-diacetoxy-9,11-epoxy-17-nor-8,9-secolabdan-13-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H40O6
InChI InChI=1S/C23H40O6/c1-15(28-17(3)25)23(7,26)14-18-20(29-18)22(6)12-9-11-21(4,5)19(22)10-8-13-27-16(2)24/h15,18-20,26H,8-14H2,1-7H3/t15?,18-,19+,20+,22+,23-/m1/s1
InChIKey WXRKYKLOHHFSFG-UIJQDGBFSA-N
Molecular Weight 412.567 g/mol
SMILES O[C@](C[C@]1(O[C@@]1([C@@]1([C@](C(C)(C)CCC1)(CCCOC(=O)C)[H])C)[H])[H])(C(OC(=O)C)C)C
SPLASH splash10-0gvo-0009300000-34e1ad0061e006caef5a
Source of Spectrum B-44-433-0
Synonyms (3R)-3-{[(2R,3R)-3-[(1S,2R)-2-[(3S)-3-(acetyloxy)butyl]-3,3-dimethylcyclohexyl]oxiran-2-yl]methyl}-3-hydroxybutan-2-yl acetate Acetic acid (R)-3-{(2R,3R)-3-[(1S,2S)-2-(3-acetoxy-propyl)-1,3,3-trimethyl-cyclohexyl]-oxiranyl}-2-hydroxy-1,2-dimethyl-propyl ester
Wiley ID 1374480