SpectraBase Spectrum ID |
H1B6tmb9Fkm |
Name |
2-[(3R,4R)-3-hydroxy-6-keto-4-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]cyclohexen-1-yl]acetic acid methyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H44O4 |
InChI |
InChI=1S/C29H44O4/c1-21(2)10-7-11-22(3)12-8-13-23(4)14-9-15-24(5)16-17-25-18-28(31)26(19-27(25)30)20-29(32)33-6/h10,12,14,16,19,25,27,30H,7-9,11,13,15,17-18,20H2,1-6H3/b22-12+,23-14+,24-16+/t25-,27+/m1/s1 |
InChIKey |
MENMOQUCYNYTBV-IKBJAONLSA-N |
Molecular Weight |
456.667 g/mol |
SMILES |
O[C@]1(C=C(C(C[C@]1(C\C=C\(CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)C)[H])=O)CC(=O)OC)[H] |
SPLASH |
splash10-014r-9610200000-891d8c4fd46624ac0519 |
Source of Spectrum |
F-49-9282-1 |
Synonyms |
2-[(3R,4R)-3-hydroxy-6-oxo-4-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]-1-cyclohexenyl]acetic acid methyl ester
Methyl 2-[(3R,4R)-3-hydroxy-6-oxo-4-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]cyclohexen-1-yl]acetate
Methyl 2-[(3R,4R)-3-oxidanyl-6-oxidanylidene-4-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]cyclohexen-1-yl]ethanoate |
Wiley ID |
788427 |