| SpectraBase Spectrum ID |
3LO2C33s73g |
| Name |
ent-3.beta.-Acetoxytrachylobane |
| Appearance |
Orange gum |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H34O2 |
| InChI |
InChI=1S/C22H34O2/c1-13(23)24-18-7-8-20(4)16(19(18,2)3)6-9-22-11-15-14(10-17(20)22)21(15,5)12-22/h14-18H,6-12H2,1-5H3/t14-,15+,16-,17+,18+,20-,21-,22-/m1/s1 |
| InChIKey |
OOFXFLVLGBRHBD-YJORMDQLSA-N |
| Instrument Name |
Hewlett-Packard G1800A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np900806j |
| Molecular Weight |
330.512 g/mol |
| Optical Rotation |
[a]D20 = -39.4 (c = 0.63, CHCl3) |
| Reported Formula |
C22H34O2 |
| SMILES |
C1C[C@@]2([C@@](C([C@]1(OC(C)=O)[H])(C)C)(CC[C@@]13[C@]2(C[C@]2([C@](C3)(C)[C@]2(C1)[H])[H])[H])[H])C |
| SPLASH |
splash10-0a4i-4921000000-f3643e60a1e96b17010e |
| Source of Spectrum |
G4-73-662-3 |
| Wiley ID |
1872288 |
