MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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15-epi-lipoxin B4

MNXM33428 is deprecated and here replaced by MNXM734307
!!! Alternative mappings exist !!!

	Properties	Image
MNX_ID	MNXM734307
reference	chebi:63991
formula	C₂₀H₃₂O₅
global charge	0
mol weight	352.471
InChIKey	UXVRTOKOJOMENI-SKYGSKSRSA-N
InChI	InChI=1S/C20H32O5/c1-2-3-8-14-18(22)19(23)15-10-7-5-4-6-9-12-17(21)13-11-16-20(24)25/h4-7,9-10,12,15,17-19,21-23H,2-3,8,11,13-14,16H2,1H3,(H,24,25)/b6-4-,7-5+,12-9+,15-10+/t17-,18-,19-/m1/s1
SMILES	CCCCC[C@@H](O)[C@H](O)/C=C/C=C/C=C\C=C\[C@@H](O)CCCC(=O)O

MNX internals

InChI (mnx)	InChI=1/C20H32O5/c1-2-3-8-14-18(22)19(23)15-10-7-5-4-6-9-12-17(21)13-11-16-20(24)25/h4-7,9-10,12,15,17-19,21-23H,2-3,8,11,13-14,16H2,1H3,(H,24,25)/b6-4-,7-5+,12-9+,15-10+/t17-,18-,19-/m1/s1
SMILES (mnx)	[CH3:1][CH2:2][CH2:3][CH2:8][CH2:14][C@H:18]([C@@H:19](/[CH:15]=[CH:10]/[CH:7]=[CH:5]/[CH:4]=[CH:6]\[CH:9]=[CH:12]\[C@H:17]([CH2:13][CH2:11][CH2:16][C:20](=[O:24])[OH:25])[OH:21])[OH:23])[OH:22]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	3

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-2142791 reactomeM:R-ALL-2142791 CHEBI:63991 chebi:63991 UXVRTOKOJOMENI-SKYGSKSRSA-N	15-epi-lipoxin B4 (5S,6E,8Z,10E,12E,14R,15R)-5,14,15-trihydroxyicosa-6,8,10,12-tetraenoic acid 15-epi-LXB4 5S,14R,15R-trihydroxy-6E,8Z,10E,12E-eicosatetraenoic acid epi-LXB4 epi-Lipoxin B4
metacyc.compound:CPD66-54 metacycM:CPD66-54 seed.compound:cpd33389 seedM:cpd33389 UXVRTOKOJOMENI-SKYGSKSRSA-M	15 epi-lipoxin B4 5S,14R,15R-trihydroxy-6E,8Z,10E,12E-eicosatetraenoate epi-Lipoxin B4
bigg.metabolite:CE2569 biggM:CE2569 vmhM:CE2569 vmhmetabolite:CE2569 UXVRTOKOJOMENI-SKYGSKSRSA-N	15-epi-lipoxin B4
lipidmaps:LMFA03040007 lipidmapsM:LMFA03040007 UXVRTOKOJOMENI-SKYGSKSRSA-N	epi-Lipoxin B4 5S,14R,15R-trihydroxy-6E,8Z,10E,12E-eicosatetraenoic acid FA 20:4 O3 epi-LXB4
biggM:M_CE2569 seedM:M_cpd33389 vmhM:M_CE2569	secondary/obsolete/fantasy identifier