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4-nonacosene-2-one

PropertiesImage
MNX_IDMNXM37679 Image of MNXM37679
referencemetacycM:CPD-8493
formulaC29H56O
global charge0
mol weight420.766
InChIKeyHDRJGTJDEUIPPK-CYYJNZCTSA-N
InChIInChI=1S/C29H56O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29(2)30/h26-27H,3-25,28H2,1-2H3/b27-26+
SMILESCCCCCCCCCCCCCCCCCCCCCCCC/C=C/CC(C)=O
MNX internals
InChI (mnx)InChI=1/C29H56O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29(2)30/h26-27H,3-25,28H2,1-2H3/b27-26+ Image of MNXM37679
SMILES (mnx)[CH3:1][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][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]/[CH:26]=[CH:27]/[CH2:28][C:29]([CH3:2])=[O:30]
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

metacyc.compound:CPD-8493
metacycM:CPD-8493
seed.compound:cpd25313
seedM:cpd25313
HDRJGTJDEUIPPK-CYYJNZCTSA-N
4-nonacosene-2-one

seedM:M_cpd25313
secondary/obsolete/fantasy identifier