| SpectraBase Spectrum ID |
6PgpeayhvpI |
| Name |
(1R,3S,4S,5S,7R,9R,10R,11R)-1,7-Diacetyloxy-9-p-nitrobenzoyloxylongipinane |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H33NO8 |
| InChI |
InChI=1S/C26H33NO8/c1-13-11-18(33-14(2)28)22-23-21(13)26(22,6)20(12-19(25(23,4)5)34-15(3)29)35-24(30)16-7-9-17(10-8-16)27(31)32/h7-10,13,18-23H,11-12H2,1-6H3/t13-,18+,19+,20+,21-,22+,23-,26+/m0/s1 |
| InChIKey |
JTJDMIQMJDXWOK-WRRDGSAQSA-N |
| Instrument Name |
Hewlett-Packard 5989A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np020158s |
| Molecular Weight |
487.549 g/mol |
| Optical Rotation |
[a] = +3 (589 nm), +3 (578 nm), +4 (546 nm), +19 (436 nm) (c = 0.16, CHCl3) |
| SMILES |
[C@@]1(OC(=O)C)([C@@]2([H])[C@]3(C)[C@@](C[C@@](OC(=O)C)(C(C)(C)[C@@]2([H])[C@]3([H])[C@@](C)(C1)[H])[H])(OC(c1ccc(cc1)[N+]([O-])=O)=O)[H])[H] |
| SPLASH |
splash10-0uy0-3981000000-fecb8d767539ec5c921f |
| Source of Spectrum |
G4-65-1410-41 |
| Wiley ID |
1883401 |
