SpectraBase Spectrum ID |
7qgs5fnQIlT |
Name |
8-O-Acetoacetyl-13(R),14(R)-epoxy-15-iodo-epi-aplysin-20 [8-O-Acetoacetyl-3-bromo-4,4,8,10-tetramethyl-9-(3-methyl-5-iodo-3(R),4(R)-epoxypentyl)decahydronaphthalene] |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C24H38BrIO4 |
InChI |
InChI=1S/C24H38BrIO4/c1-15(27)13-20(28)30-23(5)11-7-16-21(2,3)18(25)9-10-22(16,4)17(23)8-12-24(6)19(14-26)29-24/h16-19H,7-14H2,1-6H3/t16-,17?,18-,19-,22-,23+,24-/m1/s1 |
InChIKey |
KUWFUEXQMXBGTJ-DRWXDSHJSA-N |
Molecular Weight |
597.372 g/mol |
SMILES |
[C@]12([C@@](C(C)(C)[C@@](CC2)(Br)[H])(CC[C@@](C1CC[C@]1(O[C@@]1(CI)[H])C)(OC(CC(=O)C)=O)C)[H])C |
SPLASH |
splash10-0002-9005000000-c72262dab1202a3e5178 |
Source of Spectrum |
AJ-65-2302-8 |
Synonyms |
(1S,2S,4aS,6R,8aR)-6-bromo-1-{2-[(2R,3S)-3-(iodomethyl)-2-methyloxiranyl]ethyl}-2,5,5,8a-tetramethyldecahydro-2-naphthalenyl 3-oxobutanoate |
Wiley ID |
771697 |