| SpectraBase Spectrum ID |
KvD9gAEmEJO |
| Name |
2-[2-[(1S,3S)-3-carbamoyl-2,3,4,9-tetrahydro-1H-$b-carbolin-1-yl]ethyl]malonic acid diethyl ester |
| Alternate Name(s) |
2-[2-[(1S,3S)-3-carbamoyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]ethyl]propanedioic acid diethyl ester
Diethyl 2-[2-[(1S,3S)-3-aminocarbonyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]ethyl]propanedioate
Diethyl 2-[2-[(1S,3S)-3-carbamoyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]ethyl]propanedioate |
| CAS Registry Number |
117626-45-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H27N3O5 |
| InChI |
InChI=1S/C21H27N3O5/c1-3-28-20(26)13(21(27)29-4-2)9-10-16-18-14(11-17(23-16)19(22)25)12-7-5-6-8-15(12)24-18/h5-8,13,16-17,23-24H,3-4,9-11H2,1-2H3,(H2,22,25)/t16-,17-/m0/s1 |
| InChIKey |
JFJLMCAECWCMRY-IRXDYDNUSA-N |
| Molecular Weight |
401.463 g/mol |
| SMILES |
[nH]1c2c(c3C[C@@](C(=O)N)(N[C@](c13)(CCC(C(=O)OCC)C(=O)OCC)[H])[H])cccc2 |
| SPLASH |
splash10-02t9-8490200000-8cae7dd25114b33f6f5f |
| Source of Spectrum |
C-111-307-24 |
| Wiley ID |
1369972 |
![2-[2-[(1S,3S)-3-carbamoyl-2,3,4,9-tetrahydro-1H-$b-carbolin-1-yl]ethyl]malonic acid diethyl ester](/api/spectrum/KvD9gAEmEJO/structure.png?h=300&w=458 "2-[2-[(1S,3S)-3-carbamoyl-2,3,4,9-tetrahydro-1H-$b-carbolin-1-yl]ethyl]malonic acid diethyl ester")
