| SpectraBase Spectrum ID |
4DTzWMV0bUg |
| Name |
(1S,5S,6R,7R)-7-Hydroxy-6-[(E,3S,4S)-3-hydroxy-5-methyl-1-nonenyl]-3-(3-methoxycarbonylbenzyl)bicyclo[3.3.0]-2-octene |
| Alternate Name(s) |
Methyl 3-({(3aS,5R,6R,6aS)-5-hydroxy-6-[(1E,3S)-3-hydroxy-5-methyl-1-nonenyl]-1,3a,4,5,6,6a-hexahydro-2-pentalenyl}methyl)benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H38O4 |
| InChI |
InChI=1S/C27H38O4/c1-4-5-7-18(2)12-23(28)10-11-24-25-16-20(15-22(25)17-26(24)29)13-19-8-6-9-21(14-19)27(30)31-3/h6,8-11,14-15,18,22-26,28-29H,4-5,7,12-13,16-17H2,1-3H3/b11-10+/t18?,22-,23+,24+,25-,26+/m0/s1 |
| InChIKey |
WDSYLXLVQYZXTE-QCICJHASSA-N |
| Molecular Weight |
426.597 g/mol |
| SMILES |
O[C@](\C=C\[C@@]1([C@@]2([C@](C[C@]1(O)[H])(C=C(C2)Cc1cc(C(=O)OC)ccc1)[H])[H])[H])(CC(CCCC)C)[H] |
| SPLASH |
splash10-01ot-0965400000-95e5b6ec868c037040b6 |
| Source of Spectrum |
F-51-5538-9 |
| Wiley ID |
791936 |
![(1S,5S,6R,7R)-7-Hydroxy-6-[(E,3S,4S)-3-hydroxy-5-methyl-1-nonenyl]-3-(3-methoxycarbonylbenzyl)bicyclo[3.3.0]-2-octene](/api/spectrum/4DTzWMV0bUg/structure.png?h=300&w=458 "(1S,5S,6R,7R)-7-Hydroxy-6-[(E,3S,4S)-3-hydroxy-5-methyl-1-nonenyl]-3-(3-methoxycarbonylbenzyl)bicyclo[3.3.0]-2-octene")
