| SpectraBase Spectrum ID |
7OHoPxn9DoN |
| Name |
1.alpha.,6.beta.-Diacetoxy-8.alpha.,13R*-epoxy-14-labden-11-one |
| Appearance |
Colorless needles |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H36O6 |
| InChI |
InChI=1S/C24H36O6/c1-9-22(6)12-16(27)19-23(7,30-22)13-17(28-14(2)25)20-21(4,5)11-10-18(24(19,20)8)29-15(3)26/h9,17-20H,1,10-13H2,2-8H3/t17-,18+,19+,20+,22+,23-,24-/m1/s1 |
| InChIKey |
UCYVBJBGLQZGCI-DGQCHYMOSA-N |
| Instrument Name |
Hewlett-Packard 5973 |
| Ionization Type |
EI Positive ion |
| Literature Reference DOI |
10.1021/np020203w |
| Molecular Weight |
420.546 g/mol |
| Optical Rotation |
[a]D20 = -81.5 (c = 0.114, CHCl3) |
| SMILES |
C1[C@@]([C@]2([C@](C(C1)(C)C)([C@@](C[C@@]1([C@]2([H])C(C[C@@](O1)(C=C)C)=O)C)(OC(C)=O)[H])[H])C)(OC(=O)C)[H] |
| SPLASH |
splash10-0006-9310000000-55bb5b941973f4d20ac4 |
| Source of Spectrum |
G4-65-1389-3 |
| Synonyms |
Plectrornatin C |
| Wiley ID |
1883417 |
