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heptadecanoate

PropertiesImage
MNX_IDMNXM11802 Image of MNXM11802
referencechebi:32366
formulaC17H33O2
global charge-1
mol weight269.449
InChIKeyKEMQGTRYUADPNZ-UHFFFAOYSA-M
InChIInChI=1S/C17H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h2-16H2,1H3,(H,18,19)/p-1
SMILESCCCCCCCCCCCCCCCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C17H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h2-16H2,1H3,(H,18,19) Image of MNXM11802
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][C:17](=[O:18])[OH:19]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)9
in models (compartimentalized) 11
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:32366
chebi:32366
KEMQGTRYUADPNZ-UHFFFAOYSA-M
heptadecanoate
(17:0)
CH3-[CH2]15-COO(-)
heptadecanoate anion
margarate
margarinate
margaroate
n-heptadecanoate
n-heptadecoate
n-heptadecylate

bigg.metabolite:hpdca
biggM:hpdca
KEMQGTRYUADPNZ-UHFFFAOYSA-M
Heptadecanoate C170
hmdb:HMDB0002259
KEMQGTRYUADPNZ-UHFFFAOYSA-N
Heptadecanoic acid
17:0
C17:0
CH3-[CH2]15-COOH
FA(17:0)
Heptadecanoate
Heptadecoate
Heptadecoic acid
Heptadecylate
Heptadecylic acid
Margarate
Margaric acid
Margaric acid, 1-(11)C-labeled
Margaric acid, nickel (2+) salt
Margaric acid, potassium salt
Margaric acid, sodium salt
Margarinate
Margarinic acid
Margarinsaeure
Margaroate
Margaroic acid
N-Heptadecanoate
N-Heptadecanoic acid
N-Heptadecoate
N-Heptadecoic acid
N-Heptadecylate
N-Heptadecylic acid
Normal-heptadecanoate
Normal-heptadecanoic acid
Omega I-123 heptadecanoic acid
heptadecanoic acid

CHEBI:168047
chebi:168047
KEMQGTRYUADPNZ-UHFFFAOYSA-N
Margaric acid(d3)
17,17,17-trideuterioheptadecanoic acid

lipidmaps:LMFA01010048
lipidmapsM:LMFA01010048
KEMQGTRYUADPNZ-UHFFFAOYSA-N
Margaric acid(d3)
Heptadecanoic acid(d3)

lipidmaps:LMFA01010017
lipidmapsM:LMFA01010017
KEMQGTRYUADPNZ-UHFFFAOYSA-N
Margaric acid
C17:0
Daturic acid
Daturinic acid
FA 17:0
Heptadecylic acid
Margarinic acid
heptadecanoic acid

envipath:...7a0972a4cc4b
envipathM:...7a0972a4cc4b
KEMQGTRYUADPNZ-UHFFFAOYSA-M
compound 0114545

seed.compound:cpd24916
seedM:cpd24916
KEMQGTRYUADPNZ-UHFFFAOYSA-M
heptadecanoate
Heptadecanoic_acid
heptadecanoic acid
margarate
margaric acid

SLM:000001095
slm:000001095
KEMQGTRYUADPNZ-UHFFFAOYSA-M
heptadecanoate
Heptadecylate
Margirate

metacyc.compound:CPD-7830
metacycM:CPD-7830
KEMQGTRYUADPNZ-UHFFFAOYSA-M
heptadecanoate
heptadecanoic acid
margarate
margaric acid

CHEBI:32365
chebi:32365
KEMQGTRYUADPNZ-UHFFFAOYSA-N
heptadecanoic acid
17:0
C17:0
CH3-[CH2]15-COOH
Margarinsaeure
heptadecoic acid
heptadecylic acid
margaric acid
margarinic acid
n-heptadecanoic acid
n-heptadecoic acid
n-heptadecylic acid

vmhM:hpdca
vmhmetabolite:hpdca
KEMQGTRYUADPNZ-UHFFFAOYSA-M
margarate
heptadecanoic acid

hmdb:HMDB02259
biggM:M_hpdca
seedM:M_cpd24916
vmhM:M_hpdca
secondary/obsolete/fantasy identifier