| SpectraBase Spectrum ID |
B1vxcyQdZMu |
| Name |
14-angeloyloxy-2.alpha.,3.alpha.-epoxy-1.beta.-hydroxydeltonorcacalol |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H24O7 |
| InChI |
InChI=1S/C20H24O7/c1-6-8(2)20(24)26-7-11-12-9(3)17-19(27-17)16(23)14(12)18(25-5)15(22)13(11)10(4)21/h6,9,16-17,19,22-23H,7H2,1-5H3/b8-6-/t9-,16+,17+,19-/m1/s1 |
| InChIKey |
MTYVORPSHXIKQD-GTNOQCDASA-N |
| Instrument Name |
HP 5988A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np1004505 |
| Molecular Weight |
376.405 g/mol |
| Optical Rotation |
[a]D20 = -17 (c = 1.00, CHCl3) |
| Reported Formula |
C20H24O7 |
| SMILES |
Oc1c(c2c([C@]([C@]3([C@@]([C@]2(O)[H])(O3)[H])[H])(C)[H])c(c1C(=O)C)COC(=O)\C(=C/C)C)OC |
| SPLASH |
splash10-0537-9030000000-c9d8c99ae808f507cd1b |
| Source of Spectrum |
G4-73-1956-Compound 3 |
| Wiley ID |
1848892 |
