| SpectraBase Spectrum ID |
4kMFNcggnuP |
| Name |
Sclerophytin E |
| CAS Registry Number |
119456-14-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H36O5 |
| InChI |
InChI=1S/C22H36O5/c1-12(2)15-8-7-13(3)18-16-11-21(5,25)17(24)9-10-22(6,27-14(4)23)20(26-16)19(15)18/h12,15-20,24-25H,3,7-11H2,1-2,4-6H3/t15-,16-,17+,18-,19-,20-,21+,22-/m1/s1 |
| InChIKey |
MISONEVIRFNWCQ-UTEQDJHMSA-N |
| Molecular Weight |
380.525 g/mol |
| SMILES |
O[C@]1(C[C@]2(O[C@@]([C@@](CC[C@@]1(O)[H])(OC(=O)C)C)([C@]1([C@@]2(C(CC[C@@]1(C(C)C)[H])=C)[H])[H])[H])[H])C |
| SPLASH |
splash10-0aou-9675000000-be595c7aa6d648d5fa03 |
| Source of Spectrum |
X2-57-579-8 |
| Synonyms |
5,12-Epoxybenzocyclodecene-6,9,10-triol, tetradecahydro-6,10-dimethyl-1-methylene-4-(1-methylethyl)-, 6-acetate, [4R-(4R*,4aR*,5R*,6R*,9S*,10S*,12R*,12aR*)]-
(1R,2R,6R,7R,8R,9R,12S,13S)-12,13-dihydroxy-6-isopropyl-9,13-dimethyl-3-methylene-15-oxatricyclo[6.6.1.0(2,7)]pentadec-9-yl acetate |
| Wiley ID |
1605417 |
