| SpectraBase Spectrum ID |
5TNccXEf2 |
| Name |
Angiopterlactone B |
| Appearance |
J ) 6.6Colorless needles |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16O6 |
| InChI |
InChI=1S/C12H16O6/c1-4(13)9-11-8(12(15)18-9)6-3-7(14)16-5(2)10(6)17-11/h4-6,8-11,13H,3H2,1-2H3/t4-,5-,6+,8-,9+,10+,11+/m0/s1 |
| InChIKey |
QWKPTJJZSKGASL-IFRILVJUSA-N |
| Instrument Name |
Shimadzu GCMS-QP 2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np900027m |
| Molecular Weight |
256.254 g/mol |
| Optical Rotation |
[a]D20 = +22 (c 0.04, EtOAc) |
| Reported Formula |
C12H16O6 |
| SMILES |
O[C@]([C@]1(OC([C@]2([C@]3(CC(O[C@]([C@]3(O[C@@]12[H])[H])(C)[H])=O)[H])[H])=O)[H])(C)[H] |
| SPLASH |
splash10-0c0r-9830000000-9c28867ea99e9ade778e |
| Source of Spectrum |
G4-72-923-2 |
| Wiley ID |
1872182 |
