| SpectraBase Spectrum ID |
FG64PBCIxeJ |
| Name |
(R)-Marrubiastrolchloride |
| Alternate Name(s) |
(6aR,7S,8R,10aR)-7-((R)-2-chloro-2-(5-oxo-2,5-dihydrofuran-3-yl)ethyl)-7,8-dimethyl-6,6a,7,8,9,10-hexahydro-1H-naphtho[1,8a-c]furan-3(5H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H25ClO4 |
| InChI |
InChI=1S/C20H25ClO4/c1-12-6-7-20-11-25-18(23)14(20)4-3-5-16(20)19(12,2)9-15(21)13-8-17(22)24-10-13/h4,8,12,15-16H,3,5-7,9-11H2,1-2H3/t12-,15-,16-,19+,20+/m1/s1 |
| InChIKey |
VWXQFWPRIJZUSH-OZZRQTCFSA-N |
| Literature Reference DOI |
10.1002/cber.19781110610 |
| Molecular Weight |
364.869 g/mol |
| SMILES |
C1C[C@]2([C@@]3(C(=C1)C(OC3)=O)CC[C@]([C@@]2(C[C@](C=1COC(C1)=O)(Cl)[H])C)(C)[H])[H] |
| SPLASH |
splash10-01ow-2942000000-ab9d3f92683536cbd6db |
| Source of Spectrum |
K-111-2139-3a |
| Wiley ID |
1794266 |
