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(22Z)-Hentriacont-22-ene-2,4-dione

PropertiesImage
MNX_IDMNXM115522 Image of MNXM115522
referencechebi:185350
formulaC31H58O2
global charge0
mol weight462.803
InChIKeyPCUWNQVNMSDXMY-KHPPLWFESA-N
InChIInChI=1S/C31H58O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-31(33)29-30(2)32/h10-11H,3-9,12-29H2,1-2H3/b11-10-
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCCCCCC(=O)CC(C)=O
MNX internals
InChI (mnx)InChI=1/C31H58O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-31(33)29-30(2)32/h10-11H,3-9,12-29H2,1-2H3/b11-10- Image of MNXM115522
SMILES (mnx)[CH3:1][CH2:3][CH2:4][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][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][C:31]([CH2:29][C:30]([CH3:2])=[O:32])=[O:33]
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
IdentifierDescription

CHEBI:185350
chebi:185350
PCUWNQVNMSDXMY-KHPPLWFESA-N
(22Z)-Hentriacont-22-ene-2,4-dione
(Z)-hentriacont-22-ene-2,4-dione
hmdb:HMDB0035953
PCUWNQVNMSDXMY-KHPPLWFESA-N
(Z)-22-Hentriacontene-2,4-dione
(22Z)-hentriacont-22-ene-2,4-dione

hmdb:HMDB35953
secondary/obsolete/fantasy identifier