| SpectraBase Spectrum ID |
Bjan43y55qY |
| Name |
1H-Naphtho[1,8a-c]furan-3(5H)-one, 7-[2-(2,5-dihydro-5-oxo-3-furanyl)-2-oxoethyl]-6,6a,7,8,9,10-hexahydr o-7,8-dimethyl-, [6aR-(6a.alpha.,7.alpha.,8.beta.,10aR*)]- |
| Alternate Name(s) |
(7S,8R,10aR)-7,8-dimethyl-7-[2-oxo-2-(5-oxo-2,5-dihydro-3-furanyl)ethyl]-6,6a,7,8,9,10-hexahydronaphtho[1,8a-c]furan-3(5H)-one
12-Oxomarrubiastrol |
| CAS Registry Number |
67416-29-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H24O5 |
| InChI |
InChI=1S/C20H24O5/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/h4,8,12,16H,3,5-7,9-11H2,1-2H3/t12-,16?,19+,20+/m1/s1 |
| InChIKey |
AJRKZLMFGONGLF-CVBRBTDMSA-N |
| Molecular Weight |
344.407 g/mol |
| SMILES |
[C@@]123C(C(=O)OC3)=CCCC1[C@](CC(C1=CC(=O)OC1)=O)(C)[C@@](CC2)(C)[H] |
| SPLASH |
splash10-014r-0960000000-9157edcd9b38b8d34027 |
| Source of Spectrum |
K-111-2140-0 |
| Wiley ID |
1337984 |
![1H-Naphtho[1,8a-c]furan-3(5H)-one, 7-[2-(2,5-dihydro-5-oxo-3-furanyl)-2-oxoethyl]-6,6a,7,8,9,10-hexahydr o-7,8-dimethyl-, [6aR-(6a.alpha.,7.alpha.,8.beta.,10aR*)]-](/api/spectrum/Bjan43y55qY/structure.png?h=300&w=458 "1H-Naphtho[1,8a-c]furan-3(5H)-one, 7-[2-(2,5-dihydro-5-oxo-3-furanyl)-2-oxoethyl]-6,6a,7,8,9,10-hexahydr o-7,8-dimethyl-, [6aR-(6a.alpha.,7.alpha.,8.beta.,10aR*)]-")
