| SpectraBase Spectrum ID |
IIqGcL4zxMT |
| Name |
(2S,4R,5R,7R)-5-(Benzoyloxy)-4-(3'-benzoyloxy-1'-octenyl)hexahydro-1(1H)-pentalenone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H34O5 |
| InChI |
InChI=1S/C30H34O5/c1-2-3-6-15-25(34-29(32)21-11-7-4-8-12-21)16-17-26-27-20-24(31)18-23(27)19-28(26)35-30(33)22-13-9-5-10-14-22/h4-5,7-14,16-17,23,25-28H,2-3,6,15,18-20H2,1H3/b17-16+/t23-,25?,26+,27-,28+/m0/s1 |
| InChIKey |
VFIOZYWTVBEDQH-DIOPVGKYSA-N |
| Molecular Weight |
474.597 g/mol |
| SMILES |
[C@]12([C@]([C@](OC(=O)c3ccccc3)(C[C@@]1(CC(C2)=O)[H])[H])(\C=C\C(OC(=O)c1ccccc1)CCCCC)[H])[H] |
| SPLASH |
splash10-0a4i-0900000000-205f57bc06c73152648a |
| Source of Spectrum |
U1-1998-821-7 |
| Synonyms |
(1R,2R,3aR,6aS)-1-[(1E)-3-(benzoyloxy)-1-octenyl]-5-oxooctahydro-2-pentalenyl benzoate
5-(Benzoyloxy)-4-(3'-benzoyloxy-1'-octenyl)hexahydro-1(1H)-pentalenone |
| Wiley ID |
751255 |
