| SpectraBase Spectrum ID |
1ztPBKPE8GC |
| Name |
(1S,3S,3aR,6S,6aR,10aS)-3,6,9-trimethyl-1-(2-methylprop-1-enyl)-8-oxidanyl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[e]naphthalene-7,10-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H28O3 |
| InChI |
InChI=1S/C20H28O3/c1-10(2)8-14-9-12(4)15-7-6-11(3)16-18(22)17(21)13(5)19(23)20(14,15)16/h8,11-12,14-16,21H,6-7,9H2,1-5H3/t11-,12-,14+,15+,16-,20+/m0/s1 |
| InChIKey |
QPBAITGYXGUCGL-FKOZTGTQSA-N |
| Molecular Weight |
316.441 g/mol |
| SMILES |
OC=1C([C@]2([C@@]3(C(C1C)=O)[C@](C=C(C)C)(C[C@@]([C@]3(CC[C@@]2(C)[H])[H])(C)[H])[H])[H])=O |
| SPLASH |
splash10-0a4i-1190000000-1cf474de8a53cd58743d |
| Source of Spectrum |
J-63-7089-1 |
| Synonyms |
(1S,3S,3aR,6S,6aR,10aS)-8-hydroxy-3,6,9-trimethyl-1-(2-methylprop-1-enyl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[e]naphthalene-7,10-dione
(1S,3S,3aR,6S,6aR,10aS)-8-hydroxy-3,6,9-trimethyl-1-(2-methylprop-1-enyl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[e]naphthalene-7,10-quinone |
| Wiley ID |
1317116 |
