| SpectraBase Spectrum ID |
9TUQgCVB6It |
| Name |
(+-)-Methyl-2-[3-[2-[N-Benzyl-N-(3S*,4S*,5R*)-3-(4-formyl-5-methylcyclohexenyl)amino]ethyl]indole-2-yl]-2,4-hexadienoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H36N2O3 |
| InChI |
InChI=1S/C32H36N2O3/c1-4-5-15-27(32(36)37-3)31-26(25-16-9-10-17-29(25)33-31)19-20-34(21-24-13-7-6-8-14-24)30-18-11-12-23(2)28(30)22-35/h4-11,13-18,22-23,28,30,33H,12,19-21H2,1-3H3/b5-4+,27-15-/t23-,28+,30+/m0/s1 |
| InChIKey |
FVASYAHDVGNVCV-MYCMQGKASA-N |
| Molecular Weight |
496.651 g/mol |
| SMILES |
[nH]1c2ccccc2c(c1\C(C(=O)OC)=C\C=C\C)CCN([C@]1([C@](C=O)([C@@](C)(CC=C1)[H])[H])[H])Cc1ccccc1 |
| SPLASH |
splash10-0006-8890000000-cdf99a31522ee489f62b |
| Source of Spectrum |
J-62-7954-6 |
| Synonyms |
(+-)-Methyl-2-[3-[2-[N-Benzyl-N-(3R*,4R*,5S*)-3-(4-formyl-5-methylcyclohexenyl)amino]ethyl]indole-2-yl]-2,4-hexadienoate
Methyl (2Z,4E)-2-[3-(2-{benzyl[(1S,5R,6S)-6-formyl-5-methyl-2-cyclohexen-1-yl]amino}ethyl)-1H-indol-2-yl]-2,4-hexadienoate
(2Z,4E)-2-[3-[2-[[(1R,5S,6R)-6-formyl-5-methyl-1-cyclohex-2-enyl]-(phenylmethyl)amino]ethyl]-1H-indol-2-yl]hexa-2,4-dienoic acid methyl ester
Methyl (2Z,4E)-2-[3-[2-[benzyl-[(1R,5S,6R)-6-formyl-5-methylcyclohex-2-en-1-yl]amino]ethyl]-1H-indol-2-yl]hexa-2,4-dienoate
Methyl (2Z,4E)-2-[3-[2-[benzyl-[(1R,5S,6R)-6-formyl-5-methyl-cyclohex-2-en-1-yl]amino]ethyl]-1H-indol-2-yl]hexa-2,4-dienoate
Methyl (2Z,4E)-2-[3-[2-[[(1R,5S,6R)-6-methanoyl-5-methyl-cyclohex-2-en-1-yl]-(phenylmethyl)amino]ethyl]-1H-indol-2-yl]hexa-2,4-dienoate |
| Wiley ID |
1398323 |
![(+-)-Methyl-2-[3-[2-[N-Benzyl-N-(3S*,4S*,5R*)-3-(4-formyl-5-methylcyclohexenyl)amino]ethyl]indole-2-yl]-2,4-hexadienoate](/api/spectrum/9TUQgCVB6It/structure.png?h=300&w=458 "(+-)-Methyl-2-[3-[2-[N-Benzyl-N-(3S*,4S*,5R*)-3-(4-formyl-5-methylcyclohexenyl)amino]ethyl]indole-2-yl]-2,4-hexadienoate")
