| SpectraBase Spectrum ID |
GIfnPi7BagM |
| Name |
(1R,3S,4S,5S,7R,9R,10R,11R)-7-Hydroxy-1,9-di-p-nitrobenzoyloxylongipinane |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H32N2O9 |
| InChI |
InChI=1S/C29H32N2O9/c1-15-13-20(39-26(33)16-5-9-18(10-6-16)30(35)36)24-25-23(15)29(24,4)22(14-21(32)28(25,2)3)40-27(34)17-7-11-19(12-8-17)31(37)38/h5-12,15,20-25,32H,13-14H2,1-4H3/t15-,20+,21+,22+,23-,24+,25-,29+/m0/s1 |
| InChIKey |
VZJFBWMEIBFUKR-WWTLEIMYSA-N |
| Instrument Name |
Hewlett-Packard 5989A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np020158s |
| Molecular Weight |
552.580 g/mol |
| Optical Rotation |
[a]D = -117 (589 nm), -123 (578 nm), -142 (546 nm), -281 (436 nm) (c = 0.19, CHCl3) |
| Reported Formula |
C29H32O9N2 |
| SMILES |
O[C@@]1(C[C@]([C@]2([C@@]3([C@](OC(c4ccc(cc4)[N+]([O-])=O)=O)(C[C@@]([C@]2([C@@]3(C1(C)C)[H])[H])(C)[H])[H])[H])C)(OC(=O)c1ccc(cc1)[N+]([O-])=O)[H])[H] |
| SPLASH |
splash10-0v01-4951000000-685ff34f71b633f3df04 |
| Source of Spectrum |
G4-65-1408-32 |
| Wiley ID |
1883392 |
