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heptacosanoate

PropertiesImage
MNX_IDMNXM45535 Image of MNXM45535
referencechebi:78020
formulaC27H53O2
global charge-1
mol weight409.719
InChIKeyVXZBFBRLRNDJCS-UHFFFAOYSA-M
InChIInChI=1S/C27H54O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(28)29/h2-26H2,1H3,(H,28,29)/p-1
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C27H54O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(28)29/h2-26H2,1H3,(H,28,29) Image of MNXM45535
SMILES (mnx)[CH3:1][CH2:2][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][CH2:26][C:27](=[O:28])[OH:29]
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:78020
chebi:78020
VXZBFBRLRNDJCS-UHFFFAOYSA-M
heptacosanoate
carbocerate

lipidmaps:LMFA01010027
lipidmapsM:LMFA01010027
VXZBFBRLRNDJCS-UHFFFAOYSA-N
Carboceric acid
C27:0
FA 27:0
heptacosanoic acid

SLM:000000980
slm:000000980
VXZBFBRLRNDJCS-UHFFFAOYSA-M
Heptacosanate
hmdb:HMDB0002063
VXZBFBRLRNDJCS-UHFFFAOYSA-N
Heptacosanoic acid
C27:0
Carbocerate
Carboceric acid
Heptacosanoate
heptacosanoic acid

seed.compound:cpd24915
seedM:cpd24915
VXZBFBRLRNDJCS-UHFFFAOYSA-M
carbocerate
carboceric acid
heptacosanoate
heptacosanoic acid

metacyc.compound:CPD-7829
metacycM:CPD-7829
VXZBFBRLRNDJCS-UHFFFAOYSA-M
heptacosanoate
carbocerate
carboceric acid
heptacosanoic acid

CHEBI:78710
chebi:78710
VXZBFBRLRNDJCS-UHFFFAOYSA-N
heptacosanoic acid
C27:0
Carboceric acid

hmdb:HMDB02063
seedM:M_cpd24915
secondary/obsolete/fantasy identifier