| SpectraBase Spectrum ID |
5NWoFnclv1c |
| Name |
Marrubiastrol-acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O6 |
| InChI |
InChI=1S/C22H28O6/c1-13-7-8-22-12-27-20(25)16(22)5-4-6-18(22)21(13,3)10-17(28-14(2)23)15-9-19(24)26-11-15/h5,9,13,17-18H,4,6-8,10-12H2,1-3H3/t13-,17-,18-,21+,22+/m1/s1 |
| InChIKey |
DGFCGCYKVDHQEE-UFSOIVCBSA-N |
| Literature Reference DOI |
10.1002/cber.19781110610 |
| Molecular Weight |
388.460 g/mol |
| SMILES |
C1C[C@]2([C@@]3(C(=C1)C(OC3)=O)CC[C@]([C@@]2(C[C@](C=1COC(C1)=O)(OC(C)=O)[H])C)(C)[H])[H] |
| SPLASH |
splash10-014r-3986000000-c2b3dff0bacac025c9c4 |
| Source of Spectrum |
K-111-2138-2 |
| Synonyms |
(R)-2-((6aR,7S,8R,10aR)-7,8-dimethyl-3-oxo-3,5,6,6a,7,8,9,10-octahydro-1H-naphtho[1,8a-c]furan-7-yl)-1-(5-oxo-2,5-dihydrofuran-3-yl)ethyl acetate |
| Wiley ID |
1794265 |
