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3-coumaric acid
MNXM731858 is deprecated and here replaced by MNXM1107994
!!! Alternative mappings exist !!!
| Properties | Image |
MNX_ID | MNXM1107994 |
 |
reference | chebi:47925 |
formula | C9H8O3 |
global charge | 0 |
mol weight | 164.16 |
InChIKey | KKSDGJDHHZEWEP-UHFFFAOYSA-N |
InChI | InChI=1S/C9H8O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6,10H,(H,11,12) |
SMILES | O=C(O)C=CC1=CC=CC(O)=C1 |
MNX internals
InChI (mnx) | InChI=1/C9H8O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6,10H,(H,11,12)/b5-4? |
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SMILES (mnx) | [CH:1]1=[CH:2][C:7]([CH:4]=[CH:5][C:9](=[O:11])[OH:12])=[CH:6][C:8]([OH:10])=[CH:3]1 |
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Parent-child relations graph |
Occurences in reactions | #reac |
in my sandbox |
0 |
in MNXref (generic) | 2 |
in models (compartimentalized) |
0 |
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Similar chemical compounds in external resources
Identifier | Description |
CHEBI:47925 chebi:47925 KKSDGJDHHZEWEP-UHFFFAOYSA-N
| 3-coumaric acid 3-(3-hydroxyphenyl)-2-propenoic acid 3-(3-hydroxyphenyl)acrylic acid 3-(3-hydroxyphenyl)prop-2-enoic acid 3-hydroxycinnamic acid m-coumaric acid m-hydroxycinnamic acid
|
sabiork.compound:27751 sabiorkM:27751 KKSDGJDHHZEWEP-UHFFFAOYSA-N
| 3-Hydroxycinnamate
|
CHEBI:47927 chebi:47927 KKSDGJDHHZEWEP-UHFFFAOYSA-M
| 3-coumarate 3-(3-hydroxyphenyl)acrylate 3-(3-hydroxyphenyl)prop-2-enoate
|