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thromboxane A2

Properties

Image

Occurences in reactions

MNX_ID

MNXM1445

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	8

formula

C₂₀H₃₁O₅

charge

-1

mass

351.2177

reference

chebi:57445

InChIKey

DSNBHJFQCNUKMA-SCKDECHMSA-M

InChI

InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18-14-20(24-17)25-18)10-7-4-5-8-11-19(22)23/h4,7,12-13,15-18,20-21H,2-3,5-6,8-11,14H2,1H3,(H,22,23)/p-1/b7-4-,13-12+/t15-,16+,17+,18-,20+/m0/s1

SMILES

CCCCC[C@H](O)/C=C/[C@H]1O[C@H]2C[C@H](O2)[C@@H]1C/C=C\CCCC(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57445 chebi:57445	thromboxane A2 (5Z,13E,15S)-9alpha,11alpha-epoxy-15-hydroxythromboxa-5,13-dien-1-oate thromboxane A2 anion thromboxane A2(1-)
lipidmaps:LMFA03030001 lipidmapsM:LMFA03030001	TXA2 9S,11S-epoxy,15S-hydroxy-thromboxa-5Z,13E-dien-1-oic acid FA 20:4 O3 Thromboxane A2
bigg.metabolite:txa2 biggM:txa2	Thromboxane A2
hmdb:HMDB0001452	Thromboxane A2 (1S-(1alpha,3alpha,3R),4beta(Z),5alpha)-7-(3-(3-hydroxy-1-octenyl)-2,6-dioxabicyclo(3.1.1)hept-4-yl)-5-heptenoate (1S-(1alpha,3alpha,3R),4beta(Z),5alpha)-7-(3-(3-hydroxy-1-octenyl)-2,6-dioxabicyclo(3.1.1)hept-4-yl)-5-heptenoic acid (5Z)-7-[(1S,3R,4S,5S)-3-[(1E,3S)-3-Hydroxy-1-octenyl]-2,6-dioxabicyclo[3.1.1]hept-4-yl]-5-heptenoate (5Z)-7-[(1S,3R,4S,5S)-3-[(1E,3S)-3-Hydroxy-1-octenyl]-2,6-dioxabicyclo[3.1.1]hept-4-yl]-5-heptenoic acid (5Z)-7-[(1S,3R,4S,5S)-3-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-2,6-dioxabicyclo[3.1.1]heptan-4-yl]hept-5-enoic acid (5Z,13E)-(15S)-9,11-Epoxy-15-hydroxythromba-5,13-dienoate (5Z,13E)-(15S)-9,11-Epoxy-15-hydroxythromba-5,13-dienoic acid (5Z,13E)-(15S)-9-alpha,11-alpha-Epoxy-15-hydroxythromboxa-5,13-dienoate (5Z,13E)-(15S)-9-alpha,11-alpha-Epoxy-15-hydroxythromboxa-5,13-dienoic acid (5Z,13E)-(15S)-9a,11a-Epoxy-15-hydroxythromboxa-5,13-dienoate (5Z,13E)-(15S)-9a,11a-Epoxy-15-hydroxythromboxa-5,13-dienoic acid (5Z,13E)-(15S)-9alpha,11alpha-Epoxy-15-hydroxythromboxa-5,13-dienoate (5Z,13E)-(15S)-9alpha,11alpha-Epoxy-15-hydroxythromboxa-5,13-dienoic acid (5Z,13E)-(15S)-9alpha,11alpha-epoxy-15-hydroxythromboxa-5,13-dienoate (5Z,13E)-(15S)-9alpha,11alpha-epoxy-15-hydroxythromboxa-5,13-dienoic acid (5Z,9a,11a,13E,15S)-9,11-Epoxy-15-hydroxythromboxa-5,13-dien-1-Oate (5Z,9a,11a,13E,15S)-9,11-Epoxy-15-hydroxythromboxa-5,13-dien-1-Oic acid (5Z,9alpha,11alpha,13E,15S)-9,11-Epoxy-15-hydroxy-thromboxa-5,13-dien-1-Oate (5Z,9alpha,11alpha,13E,15S)-9,11-Epoxy-15-hydroxy-thromboxa-5,13-dien-1-Oic acid (5Z,9alpha,11alpha,13E,15S)-9,11-Epoxy-15-hydroxythromboxa-5,13-dien-1-Oate (5Z,9alpha,11alpha,13E,15S)-9,11-Epoxy-15-hydroxythromboxa-5,13-dien-1-Oic acid (5Z,9alpha,11alpha,13E,15S)-9,11-epoxy-15-hydroxythromboxa-5,13-dien-1-Oate (5Z,9alpha,11alpha,13E,15S)-9,11-epoxy-15-hydroxythromboxa-5,13-dien-1-Oic acid 7-[3-(3-Hydroxy-1-octenyl)-2,6-dioxabicyclo[3.1.1]hept-4-yl]-[1S-[1alpha,3alpha(1E,3R),4beta(Z),5alpha]]-5-heptenoate 7-[3-(3-Hydroxy-1-octenyl)-2,6-dioxabicyclo[3.1.1]hept-4-yl]-[1S-[1alpha,3alpha(1E,3R),4beta(Z),5alpha]]-5-heptenoic acid 9S,11S-Epoxy,15S-hydroxy-thromboxa-5Z,13E-dien-1-Oate 9S,11S-Epoxy,15S-hydroxy-thromboxa-5Z,13E-dien-1-Oic acid Cid RCS Rabbit aorta contracting substance TXA-2 TXA2 a2, Thromboxane thromboxane
seed.compound:cpd01480 seedM:cpd01480	Thromboxane A2 (5Z, 9alpha,11 alpha,13E,15S)-9,11-epoxy-15-hydroxythromboxa- 5,13-dien-1-oic acid (5Z,13E)-(15S)-9alpha,11alpha-Epoxy-15-hydroxythromboxa-5,13- dienoate (5Z,13E)-(15S)-9alpha,11alpha-Epoxy-15-hydroxythromboxa-5,13-dienoate (5Z,13E)-(15S)-9alpha,11alpha-epoxy-15-hydroxythromboxa-5,13-dienoate (5Z,9alpha,11alpha,13E,15S)-9,11-Epoxy-15-hydroxythromboxa-5,13- dien-1-oic acid (5Z,9alpha,11alpha,13E,15S)-9,11-Epoxy-15-hydroxythromboxa-5,13-dien-1-oic acid TXA2 thromboxane A2
kegg.compound:C02198 keggC:C02198	Thromboxane A2 (5Z,13E)-(15S)-9alpha,11alpha-Epoxy-15-hydroxythromboxa-5,13-dienoate (5Z,9alpha,11alpha,13E,15S)-9,11-Epoxy-15-hydroxythromboxa-5,13-dien-1-oic acid TXA2
SLM:000390041 slm:000390041	Thromboxane A2 TXA2
metacyc.compound:ALPHA11-ALPHA-EPOXY-15-HYDROXYTHROMBA metacycM:ALPHA11-ALPHA-EPOXY-15-HYDROXYTHROMBA	thromboxane A2 (5Z, 9alpha,11 alpha,13E,15S)-9,11-epoxy-15-hydroxythromboxa- 5,13-dien-1-oic acid (5Z,13E)-(15S)-9alpha,11alpha-epoxy-15-hydroxythromboxa-5,13-dienoate
reactome:R-ALL-32879 reactomeM:R-ALL-32879 reactome:R-ALL-391932 reactomeM:R-ALL-391932 CHEBI:15627 chebi:15627	thromboxane A2 (5Z,13E)-(15S)-9alpha,11alpha-Epoxy-15-hydroxythromboxa-5,13-dienoate (5Z,13E,15S)-9alpha,11alpha-epoxy-15-hydroxythromboxa-5,13-dien-1-oic acid (5Z,9alpha,11alpha,13E,15S)-9,11-Epoxy-15-hydroxythromboxa-5,13-dien-1-oic acid 9S,11S-epoxy,15S-hydroxy-thromboxa-5Z,13E-dien-1-oic acid TXA-2 TXA2 Thromboxane A2
hmdb:HMDB01452 chebi:10915 chebi:18589 chebi:26993 chebi:9575 biggM:M_txa2 keggC:M_C02198 seedM:M_cpd01480	secondary/obsolete/fantasy identifier