SpectraBase Spectrum ID |
8U0lAmbcszw |
Name |
(1S,2E,4S,6R,7E,11S,12S)-11,12-Epoxy-2,7-cembradiene-4,6,15-triol |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
338.245709571 u |
Formula |
C20H34O4 |
InChI |
InChI=1S/C20H34O4/c1-14-6-7-17-20(5,24-17)11-9-15(18(2,3)22)8-10-19(4,23)13-16(21)12-14/h8,10,12,15-17,21-23H,6-7,9,11,13H2,1-5H3/b10-8+,14-12+/t15-,16-,17-,19+,20-/m0/s1 |
InChIKey |
BAWRSPCHBFWGSA-GTYUMWDWSA-N |
Molecular Weight |
338.488 g/mol |
SMILES |
[C@@]12(O[C@]2(CC\C(=C\[C@](O)(C[C@@](\C=C\[C@](C(O)(C)C)(CC1)[H])(O)C)[H])C)[H])C |