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cholesteryl (5Z,8Z,11Z,14Z)-eicosatetraenoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM1104132

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	9

formula

C₄₇H₇₆O₂

charge

mass

672.58453

reference

chebi:82751

InChIKey

IMXSFYNMSOULQS-BEDFLICRSA-N

InChI

InChI=1S/C47H76O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-45(48)49-40-32-34-46(5)39(36-40)28-29-41-43-31-30-42(38(4)26-24-25-37(2)3)47(43,6)35-33-44(41)46/h11-12,14-15,17-18,20-21,28,37-38,40-44H,7-10,13,16,19,22-27,29-36H2,1-6H3/b12-11-,15-14-,18-17-,21-20-/t38-,40+,41+,42-,43+,44+,46+,47-/m1/s1

SMILES

CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@@H]3[C@@H]2CC[C@@]2(C)[C@H]3CC[C@@H]2[C@H](C)CCCC(C)C)C1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:82751 chebi:82751	cholesteryl (5Z,8Z,11Z,14Z)-eicosatetraenoate (3beta)-cholest-5-en-3-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate 20:4 Cholesteryl ester CE(20:4(5Z,8Z,11Z,14Z)) CE(20:4) cholest-5-en-3beta-yl (5Z,8Z,11Z,14Z-eicosatetraenoate) cholest-5-en-3beta-yl (5Z,8Z,11Z,14Z-icosatetraenoate) cholesterol arachidonate cholesteryl arachidonate
SLM:000500280 slm:000500280	(5Z,8Z,11Z,14Z-eicosatetraenoyl)-cholesterol CE(20:4(5Z,8Z,11Z,14Z)) Cholesteryl (5Z,8Z,11Z,14Z-eicosatetraenoate) Cholesteryl ester (20:4(5Z,8Z,11Z,14Z))
lipidmaps:LMST01020014 lipidmapsM:LMST01020014	20:4 Cholesterol ester CE 20:4 CE(20:4) cholest-5-en-3beta-yl (5Z,8Z,11Z,14Z-eicosatetraenoate)
bigg.metabolite:HC02027 biggM:HC02027	Cholesterol-ester-arach
bigg.metabolite:xolest204_hs biggM:xolest204_hs	Cholesteryl Arachidonate, Cholesterol-Ester (20:4, Delta 5,8,11,14)
metacyc.compound:CPD-21830 metacycM:CPD-21830	cholesteryl arachidonate cholesterol arachidonate
biggM:M_HC02027 biggM:M_xolest204_hs	secondary/obsolete/fantasy identifier