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(1S,2S)-OPC-8

MNXM36741 is deprecated and here replaced by MNXM732651
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM732651 Image of MNXM732651
referencechebi:191855
formulaC18H29O3
global charge-1
mol weight293.427
InChIKeyBZXZFDKIRZBJEP-JMTMCXQRSA-M
InChIInChI=1S/C18H30O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h3,7,15-16H,2,4-6,8-14H2,1H3,(H,20,21)/p-1/b7-3-/t15-,16-/m0/s1
SMILESCC/C=C\C[C@@H]1C(=O)CC[C@@H]1CCCCCCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C18H30O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h3,7,15-16H,2,4-6,8-14H2,1H3,(H,20,21)/b7-3-/t15-,16-/m0/s1 Image of MNXM732651
SMILES (mnx)[CH3:1][CH2:2]/[CH:3]=[CH:7]\[CH2:11][C@H:16]1[C@@H:15]([CH2:10][CH2:8][CH2:5][CH2:4][CH2:6][CH2:9][CH2:12][C:18](=[O:20])[OH:21])[CH2:13][CH2:14][C:17]1=[O:19]
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:191855
chebi:191855
BZXZFDKIRZBJEP-JMTMCXQRSA-M 		(1S,2S)-OPC-8
(1S,2S)-OPC8 anion
8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate
8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoate
8-{(1S,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoate
OPC-8:0(1-)

lipidmaps:LMFA02010007
lipidmapsM:LMFA02010007
BZXZFDKIRZBJEP-JMTMCXQRSA-N 		(9S,13S)-10,11-dihydro-12-oxo-15-phytoenoic acid
(1S,2S)-3-oxo-2-(2'Z-pentenyl)-cyclopentaneoctanoic acid
FA 18:3
O

kegg.compound:C04780
keggC:C04780
BZXZFDKIRZBJEP-JMTMCXQRSA-N 		(9S,13S,15Z)-12-Oxo-10,11-dihydrophyto-15-enoate
(9S,13S)-10,11-Dihydro-12-oxo-15-phytoenoate
8-[(1S,2S)-3-Oxo-2-[(Z)-pent-2-enyl]cyclopentyl]octanoic acid
8-[(1S,2S)-3-Oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoate
OPC-8:0

metacyc.compound:CPD-730
metacycM:CPD-730
BZXZFDKIRZBJEP-JMTMCXQRSA-M 		(9S,13S,15Z)-12-oxo-10,11-dihydrophyto-15-enoate
(1S,2S)-OPC8
(9S,13S)-12-oxo-10,11-dihydro-15-phytoenoate
(9S,13S)-12-oxo-15-phytoenoate
3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoate
3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoic acid
8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoate
OPC-8:0
OPC8
oxopentenyl-cyclopentane-octanoic acid
hmdb:HMDB0301805
BZXZFDKIRZBJEP-JMTMCXQRSA-N 		3-Oxo-2-(2-entenyl)cyclopentaneoctanoic acid
3-oxo-2-(2-Entenyl)cyclopentaneoctanoate
8-[(1S,2S)-3-oxo-2-[(2Z)-Pent-2-en-1-yl]cyclopentyl]octanoate
8-[(1S,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl]octanoic acid
OPC-8:0

CHEBI:137132
chebi:137132
BZXZFDKIRZBJEP-JMTMCXQRSA-N 		8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid
(1S,2S)-3-oxo-2-(2'Z-pentenyl)-cyclopentaneoctanoic acid
(1S,2S)-3-oxo-2-(2Z)-2-pentenyl-cyclopentaneoctanoic acid
(1S,2S)-OPC8
(9S,13S)-10,11-dihydro-12-oxo-15-phytoenoic acid
8-[(1S,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]octanoic acid
8-{(1S,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid
OPC-8:0

seed.compound:cpd02905
seedM:cpd02905
BZXZFDKIRZBJEP-JMTMCXQRSA-M 		OPC-8:0
3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoate
3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoic acid
8-[(1R,2R)-3-Oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoate
8-[(1R,2R)-3-oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoate
OPC8
oxopentenyl-cyclopentane-octanoic acid

keggC:M_C04780
seedM:M_cpd02905 		secondary/obsolete/fantasy identifier