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Homocapsaicin
MNXM56610 is deprecated and here replaced by MNXM738266
!!! Alternative mappings exist !!!
| Properties | Image |
|---|
| MNX_ID | MNXM738266 |
 |
| reference | keggC:C20215 |
| formula | C19H29NO3 |
| global charge | 0 |
| mol weight | 319.445 |
| InChIKey | JZNZUOZRIWOBGG-FNORWQNLSA-N |
| InChI | InChI=1S/C19H29NO3/c1-15(2)9-7-5-4-6-8-10-19(22)20-14-16-11-12-17(21)18(13-16)23-3/h5,7,11-13,15,21H,4,6,8-10,14H2,1-3H3,(H,20,22)/b7-5+ |
| SMILES | COC1=C(O)C=CC(CNC(=O)CCCC/C=C/CC(C)C)=C1 |
MNX internals
| InChI (mnx) | InChI=1/C19H29NO3/c1-15(2)9-7-5-4-6-8-10-19(22)20-14-16-11-12-17(21)18(13-16)23-3/h5,7,11-13,15,21H,4,6,8-10,14H2,1-3H3,(H,20,22)/b7-5+ |
 |
| SMILES (mnx) | [CH3:1][CH:15]([CH3:2])[CH2:9]/[CH:7]=[CH:5]/[CH2:4][CH2:6][CH2:8][CH2:10][C:19](=[N:20][CH2:14][C:16]1=[CH:13][C:18]([O:23][CH3:3])=[C:17]([OH:21])[CH:12]=[CH:11]1)[OH:22] |
|
| Parent-child relations graph |
| Occurences in reactions | #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 0 |
| in models (compartimentalized) |
0 |
|
Similar chemical compounds in external resources
| Identifier | Description |
|---|
kegg.compound:C20215
keggC:C20215
JZNZUOZRIWOBGG-FNORWQNLSA-N
| Homocapsaicin
Homocapsaicin I
|
keggC:M_C20215
| secondary/obsolete/fantasy identifier
|