| SpectraBase Spectrum ID |
LQFEqkCShp4 |
| Name |
STIGMASTA-5,22(E)-DIEN-3.BETA.-OL |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
412.370516165 u |
| Formula |
C29H48O |
| InChI |
InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8+/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1 |
| InChIKey |
HCXVJBMSMIARIN-PHZDYDNGSA-N |
| Molecular Weight |
412.702 g/mol |
| Nominal Mass |
412 u |
| Number of Peaks |
255 |
| SMILES |
O[C@]1(CC[C@@]2([C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(CC=C2C1)[H])[H])([C@@](\C=C\[C@@](CC)(C(C)C)[H])(C)[H])[H])C)[H])C)[H] |
| SPLASH |
splash10-05o4-9720000000-d76e661bb3b2a150c209 |
| Source File Reference |
LMCM-21277-382M |
| Source of Spectrum |
Prof. D. Henneberg, MPI f. Kohlenforschung, Muelheim a.d.R., Germany |
| Synonyms |
STIGMASTA-5,22-DIEN-3-OL
STIGMASTA-5,22E-DIEN-3B-OL
(1S,2R,5S,10S,11S,14R,15R)-14-[(2R,3E,5S)-5-ethyl-6-methylhept-3-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-5-ol |
| Wiley ID |
8_30192 |
