| SpectraBase Spectrum ID |
9RuX6IIaSwt |
| Name |
(1R,3R)-5-[(2E)-2-[(1R,3aR,7aR)-1-[(1S)-5-hydroxy-1,5-dimethyl-hex-3-ynyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol |
| Alternate Name(s) |
(1R,3R)-5-[(2E)-2-[(1R,3aR,7aR)-1-[(2S)-6-hydroxy-6-methylhept-4-yn-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
(1R,3R)-5-[(2E)-2-[(1R,3aR,7aR)-7a-methyl-1-[(2S)-6-methyl-6-oxidanyl-hept-4-yn-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H40O3 |
| InChI |
InChI=1S/C26H40O3/c1-18(7-5-13-25(2,3)29)23-11-12-24-20(8-6-14-26(23,24)4)10-9-19-15-21(27)17-22(28)16-19/h9-10,18,21-24,27-29H,6-8,11-12,14-17H2,1-4H3/b20-10+/t18-,21+,22+,23+,24+,26+/m0/s1 |
| InChIKey |
HHGRMHMXKPQNGF-ZCZQXKTASA-N |
| Molecular Weight |
400.603 g/mol |
| SMILES |
O[C@]1(C[C@@](CC(C1)=C\C=C\1[C@@]2([C@@]([C@](CC2)([C@](CC#CC(O)(C)C)(C)[H])[H])(CCC1)C)[H])(O)[H])[H] |
| SPLASH |
splash10-0006-9200000000-fad50acae08290c5e415 |
| Source of Spectrum |
U1-1999-2247-5 |
| Wiley ID |
753781 |
![(1R,3R)-5-[(2E)-2-[(1R,3aR,7aR)-1-[(1S)-5-hydroxy-1,5-dimethyl-hex-3-ynyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol](/api/spectrum/9RuX6IIaSwt/structure.png?h=300&w=458 "(1R,3R)-5-[(2E)-2-[(1R,3aR,7aR)-1-[(1S)-5-hydroxy-1,5-dimethyl-hex-3-ynyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol")
