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prostaglandin B1

Properties

Image

Occurences in reactions

MNX_ID

MNXM78287

	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	10

formula

C₂₀H₃₁O₄

charge

-1

mass

335.22278

reference

InChIKey

YBHMPNRDOVPQIN-VSOYFRJCSA-M

InChI

InChI=1S/C20H32O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h12,14,17,21H,2-11,13,15H2,1H3,(H,23,24)/p-1/b14-12+/t17-/m0/s1

SMILES

CCCCC[C@H](O)/C=C/C1=C(CCCCCCC(=O)[O-])C(=O)CC1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:133393 chebi:133393	prostaglandin B1 (13E,15S)-15-hydroxy-9-oxoprosta-8(12),13-dien-1-oate PGB1 Prostaglandin B1 prostaglandin B1(1-)
lipidmaps:LMFA03010131 lipidmapsM:LMFA03010131	PGB1 9-oxo-15S-hydroxy-8(12),13E-prostadienoic acid FA 20:4 O2 Prostaglandin B1
sabiork.compound:5337 sabiorkM:5337	Prostaglandin B1
hmdb:HMDB0002982	Prostaglandin B1 (13E,15S)-15-Hydroxy-9-oxoprosta-8(12),13-dien-1-Oate (13E,15S)-15-Hydroxy-9-oxoprosta-8(12),13-dien-1-Oic acid 7-{2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-5-oxocyclopent-1-en-1-yl}heptanoic acid 9-oxo-15S-Hydroxy-8(12),13E-prostadienoate 9-oxo-15S-Hydroxy-8(12),13E-prostadienoic acid PGB1 Prostaglandin b1 Prostaglandin-b1 prostaglandin-B1
seed.compound:cpd00707 seedM:cpd00707 kegg.compound:C00959 keggC:C00959	Prostaglandin B1 PGB1
bigg.metabolite:HC02204 biggM:HC02204	Prostaglandin-b1
metacyc.compound:CPD-22743 metacycM:CPD-22743	prostaglandin B1 (13E,15S)-15-hydroxy-9-oxoprosta-8(12),13-dien-1-oate
CHEBI:27624 chebi:27624	prostaglandin B1 (13E,15S)-15-hydroxy-9-oxoprosta-8(12),13-dien-1-oic acid PGB1 Prostaglandin B1
hmdb:HMDB02982 chebi:26316 chebi:8506 biggM:M_HC02204 keggC:M_C00959 seedM:M_cpd00707	secondary/obsolete/fantasy identifier