For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(11R,14R)-11-Benzenesulfonyl-13,14-epoxy-labd-7-en-15-yl imidazol-1-carbothioate
SpectraBase Compound ID 7LcGB9v451P
InChI InChI=1S/C30H40N2O4S2/c1-21-12-13-24-28(2,3)14-9-15-29(24,4)26(21)23(38(33,34)22-10-7-6-8-11-22)18-30(5)25(36-30)19-35-27(37)32-17-16-31-20-32/h6-8,10-12,16-17,20,23-26H,9,13-15,18-19H2,1-5H3/t23-,24+,25-,26-,29+,30-/m1/s1
InChIKey WPDUNLCVOATEJG-MGHDMHNCSA-N
Mol Weight 556.8 g/mol
Molecular Formula C30H40N2O4S2
Exact Mass 556.24295 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FNDxCZEtZNX
Name (11R,14R)-11-Benzenesulfonyl-13,14-epoxy-labd-7-en-15-yl imidazol-1-carbothioate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H40N2O4S2
InChI InChI=1S/C30H40N2O4S2/c1-21-12-13-24-28(2,3)14-9-15-29(24,4)26(21)23(38(33,34)22-10-7-6-8-11-22)18-30(5)25(36-30)19-35-27(37)32-17-16-31-20-32/h6-8,10-12,16-17,20,23-26H,9,13-15,18-19H2,1-5H3/t23-,24+,25-,26-,29+,30-/m1/s1
InChIKey WPDUNLCVOATEJG-MGHDMHNCSA-N
Molecular Weight 556.780 g/mol
SMILES [C@@](S(=O)(=O)c1ccccc1)([C@@]1([C@@]2([C@@](C(C)(C)CCC2)([H])CC=C1C)C)[H])(C[C@]1(O[C@@]1(COC([n]1cncc1)=S)[H])C)[H]
SPLASH splash10-014i-9800200000-a9bfd722d3bdc69a3d40
Source of Spectrum F-50-158-41
Synonyms (1R)-1-[(1S,4aS,8aS)-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenyl]-3,4-anhydro-1,2-dideoxy-5-O-(1H-imidazol-1-ylcarbothioyl)-3-methyl-1-(phenylsulfonyl)-D-threo-pentitol
Wiley ID 1406389