| SpectraBase Spectrum ID |
KOxnHGVTEVk |
| Name |
(1S,5S,6S,7R)-6-(2-bromo-3(S)-hydroxy-4(S)-methyl-1-nonen-6-ynyl)-7-hydroxy-(E)-3-[4-(tert-butoxycarbonyl)-3-oxabutylidene]bicyclo[3.3.0]octane |
| CAS Registry Number |
112741-42-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H39BrO5 |
| InChI |
InChI=1S/C26H39BrO5/c1-6-7-8-9-17(2)25(30)22(27)15-21-20-13-18(12-19(20)14-23(21)28)10-11-31-16-24(29)32-26(3,4)5/h10,15,17,19-21,23,25,28,30H,6,9,11-14,16H2,1-5H3/b18-10+,22-15-/t17-,19-,20-,21+,23+,25-/m0/s1 |
| InChIKey |
SYSNXOXPBXLJAC-ICIYPPBYSA-N |
| Molecular Weight |
511.497 g/mol |
| SMILES |
O[C@@]1(C[C@]2([C@@]([C@]1(\C=C\([C@]([C@](CC#CCC)(C)[H])(O)[H])Br)[H])(C\C(C2)=C/COCC(OC(C)(C)C)=O)[H])[H])[H] |
| SPLASH |
splash10-0a4l-9200000000-6479c8a57af18d3d994f |
| Source of Spectrum |
J-53-1230-19 |
| Synonyms |
tert-Butyl {[(2E)-2-((3aS,4S,5R,6aS)-4-[(1Z,3S,4S)-2-bromo-3-hydroxy-4-methyl-1-nonen-6-ynyl]-5-hydroxyhexahydro-2(1H)-pentalenylidene)ethyl]oxy}acetate |
| Wiley ID |
1400472 |
![(1S,5S,6S,7R)-6-(2-bromo-3(S)-hydroxy-4(S)-methyl-1-nonen-6-ynyl)-7-hydroxy-(E)-3-[4-(tert-butoxycarbonyl)-3-oxabutylidene]bicyclo[3.3.0]octane](/api/spectrum/KOxnHGVTEVk/structure.png?h=300&w=458 "(1S,5S,6S,7R)-6-(2-bromo-3(S)-hydroxy-4(S)-methyl-1-nonen-6-ynyl)-7-hydroxy-(E)-3-[4-(tert-butoxycarbonyl)-3-oxabutylidene]bicyclo[3.3.0]octane")
