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1,3-Diacetoxy-4,6,12-tetradecatriene-8,10-diyne

PropertiesImage
MNX_IDMNXM1129434 Image of MNXM1129434
referencechebi:174871
formulaC18H20O4
global charge0
mol weight300.354
InChIKeyPGHCYQUSYHWJAI-NOPLWHKLSA-N
InChIInChI=1S/C18H20O4/c1-4-5-6-7-8-9-10-11-12-13-18(22-17(3)20)14-15-21-16(2)19/h4-5,10-13,18H,14-15H2,1-3H3/b5-4+,11-10+,13-12+
SMILESC/C=C/C#CC#C/C=C/C=C/C(CCOC(C)=O)OC(C)=O
MNX internals
InChI (mnx)InChI=1/C18H20O4/c1-4-5-6-7-8-9-10-11-12-13-18(22-17(3)20)14-15-21-16(2)19/h4-5,10-13,18H,14-15H2,1-3H3/b5-4+,11-10+,13-12+/t18? Image of MNXM1129434
SMILES (mnx)[CH3:1]/[CH:4]=[CH:5]/[C:6]#[C:7][C:8]#[C:9]/[CH:10]=[CH:11]/[CH:12]=[CH:13]/[CH:18]([CH2:14][CH2:15][O:21][C:16]([CH3:2])=[O:19])[O:22][C:17]([CH3:3])=[O:20]
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:174871
chebi:174871
PGHCYQUSYHWJAI-NOPLWHKLSA-N
1,3-Diacetoxy-4,6,12-tetradecatriene-8,10-diyne
[(4E,6E,12E)-3-acetyloxytetradeca-4,6,12-trien-8,10-diynyl] acetate