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(12E)-9-hydroxy-10-oxo-12-octadecenoic acid
MNXM22494 is deprecated and here replaced by MNXM732734
!!! Alternative mappings exist !!!
| Properties | Image |
| MNX_ID | MNXM732734 |
 |
| reference | chebi:143972 |
| formula | C18H32O4 |
| global charge | 0 |
| mol weight | 312.45 |
| InChIKey | KUSHOISAFGTTRU-JXMROGBWSA-N |
| InChI | InChI=1S/C18H32O4/c1-2-3-4-5-7-10-13-16(19)17(20)14-11-8-6-9-12-15-18(21)22/h7,10,17,20H,2-6,8-9,11-15H2,1H3,(H,21,22)/b10-7+ |
| SMILES | CCCCC/C=C/CC(=O)C(O)CCCCCCCC(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C18H32O4/c1-2-3-4-5-7-10-13-16(19)17(20)14-11-8-6-9-12-15-18(21)22/h7,10,17,20H,2-6,8-9,11-15H2,1H3,(H,21,22)/b10-7+/t17? |
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| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5]/[CH:7]=[CH:10]/[CH2:13][C:16]([CH:17]([CH2:14][CH2:11][CH2:8][CH2:6][CH2:9][CH2:12][CH2:15][C:18](=[O:21])[OH:22])[OH:20])=[O:19] |
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| Parent-child relations graph |
| Occurences in reactions | #reac |
| in my sandbox |
0 |
| in MNXref (generic) | 0 |
| in models (compartimentalized) |
0 |
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