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N-(4-guanidinobutyl)-4-hydroxycinnamamide
MNXM3665 is deprecated and here replaced by MNXM1369249
!!! Alternative mappings exist !!!
| Properties | Image |
MNX_ID | MNXM1369249 |
 |
reference | chebi:58644 |
formula | C14H21N4O2 |
global charge | 1 |
mol weight | 277.348 |
InChIKey | AKIHYQWCLCDMMI-UHFFFAOYSA-O |
InChI | InChI=1S/C14H20N4O2/c15-14(16)18-10-2-1-9-17-13(20)8-5-11-3-6-12(19)7-4-11/h3-8,19H,1-2,9-10H2,(H,17,20)(H4,15,16,18)/p+1 |
SMILES | NC(=[NH2+])NCCCCNC(=O)C=CC1=CC=C(O)C=C1 |
MNX internals
InChI (mnx) | InChI=1/C14H20N4O2/c15-14(16)18-10-2-1-9-17-13(20)8-5-11-3-6-12(19)7-4-11/h3-8,19H,1-2,9-10H2,(H,17,20)(H4,15,16,18)/b8-5? |
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SMILES (mnx) | [CH2:1]([CH2:2][CH2:10][NH:18][C:14](=[NH:15])[NH2:16])[CH2:9][N:17]=[C:13]([CH:8]=[CH:5][C:11]1=[CH:4][CH:7]=[C:12]([OH:19])[CH:6]=[CH:3]1)[OH:20] |
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Parent-child relations graph |
Occurences in reactions | #reac |
in my sandbox |
0 |
in MNXref (generic) | 1 |
in models (compartimentalized) |
1 |
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Similar chemical compounds in external resources
Identifier | Description |
CHEBI:58644 chebi:58644 AKIHYQWCLCDMMI-UHFFFAOYSA-O
| N-(4-guanidinobutyl)-4-hydroxycinnamamide amino[(4-{[3-(4-hydroxyphenyl)acryloyl]amino}butyl)amino]methaniminium p-coumaroylagmatine(1+)
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CHEBI:32818 chebi:32818 AKIHYQWCLCDMMI-UHFFFAOYSA-N
| p-coumaroylagmatine N-(4-Guanidinobutyl)-4-hydroxycinnamamide N-(4-Guanidinobutyl)-4-hydroxycinnamide N-(4-guanidinobutyl)-4-hydroxycinnamamide N-(4-guanidinobutyl)-p-hydroxycinnamamide N-[4-(carbamimidamido)butyl]-3-(4-hydroxyphenyl)prop-2-enamide coumaroylagmatine
|
chebi:12430 chebi:21469 chebi:21470 chebi:7089
| secondary/obsolete/fantasy identifier
|