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Vaccenyl carnitine

PropertiesImagewith InChI numberingOccurences in reactions
MNX_IDMNXM9222 Image of MNXM9222 Image of MNXM9222
#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 4
formulaC25H47NO4
charge0
mass425.654
referencebiggM:vacccrn
InChIKeyHOAMADDCQBUDDY-ZHACJKMWSA-N
InChIInChI=1S/C25H47NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(21-24(27)28)22-26(2,3)4/h10-11,23H,5-9,12-22H2,1-4H3/b11-10+
SMILES[CH3:1][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9]/[CH:10]=[CH:11]/[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][C:25](=[O:29])[O:30][CH:23]([CH2:21][C:24](=[O:27])[O-:28])[CH2:22][N+:26]([CH3:2])([CH3:3])[CH3:4]
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Similar chemical compounds in external resources
IdentifierDescription
bigg.metabolite:vacccrn
biggM:vacccrn
Vaccenyl carnitine
biggM:M_vacccrn secondary/obsolete/fantasy identifier