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9-(9Z-octadecenoyloxy)-octadecanoate

PropertiesImage
MNX_IDMNXM163230 Image of MNXM163230
referencechebi:136282
formulaC36H67O4
global charge-1
mol weight563.928
InChIKeyPGKKGBQMNNEIHV-PFONDFGASA-M
InChIInChI=1S/C36H68O4/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-25-29-33-36(39)40-34(30-26-22-19-10-8-6-4-2)31-27-23-21-24-28-32-35(37)38/h14-15,34H,3-13,16-33H2,1-2H3,(H,37,38)/p-1/b15-14-
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC(CCCCCCCCC)CCCCCCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C36H68O4/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-25-29-33-36(39)40-34(30-26-22-19-10-8-6-4-2)31-27-23-21-24-28-32-35(37)38/h14-15,34H,3-13,16-33H2,1-2H3,(H,37,38)/b15-14-/t34? Image of MNXM163230
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:12][CH2:13]/[CH:14]=[CH:15]\[CH2:16][CH2:17][CH2:18][CH2:20][CH2:25][CH2:29][CH2:33][C:36](=[O:39])[O:40][CH:34]([CH2:30][CH2:26][CH2:22][CH2:19][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[CH2:31][CH2:27][CH2:23][CH2:21][CH2:24][CH2:28][CH2:32][C:35](=[O:37])[OH:38]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:136282
chebi:136282
PGKKGBQMNNEIHV-PFONDFGASA-M 		9-(9Z-octadecenoyloxy)-octadecanoate
9-(oleoyloxy)stearate
9-OAHSA(1-)
9-[(9Z)-octadecenoyloxy]octadecanoate
9-{[(9Z)-octadec-9-enoyl]oxy}octadecanoate
oleoyl-9-hydroxystearate ester(1-)

SLM:000597731
slm:000597731
PGKKGBQMNNEIHV-PFONDFGASA-M 		9-(9Z-octadecenoyloxy)-octadecanoate

CHEBI:136996
chebi:136996
PGKKGBQMNNEIHV-PFONDFGASA-N 		9-[(9Z)-octadecenoyloxy]octadecanoic acid
9-(9Z-octadecenoyloxy)-octadecanoic acid
9-(oleoyloxy)stearic acid
9-OAHSA
9-{[(9Z)-octadec-9-enoyl]oxy}octadecanoic acid
FAHFA(18:1(9Z)/9-O-18:0)
Oleic estolide

lipidmaps:LMFA07090028
lipidmapsM:LMFA07090028
PGKKGBQMNNEIHV-PFONDFGASA-N 		FAHFA 18:1(9Z)/9O(FA 18:0)
9-(9Z-octadecenoyloxy)-octadecanoic acid
9-OAHSA
FAHFA 36:1
O
hmdb:HMDB0112109
PGKKGBQMNNEIHV-PFONDFGASA-N 		FAHFA(18:1(9Z)/9-O-18:0)
9-(9Z-Octadecenoyloxy)-octadecanoate
9-(9Z-Octadecenoyloxy)-octadecanoic acid
9-(Oleoyloxy)stearate
9-(Oleoyloxy)stearic acid
9-(oleoyloxy)octadecanoic acid
9-OAHSA
9-[(9Z)-Octadecenoyloxy]octadecanoate
9-[(9Z)-octadec-9-enoyloxy]octadecanoic acid
Oleic estolide
oleic acid-9-hydroxystearic acid