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5-(3-hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene

Properties

Image

Occurences in reactions

MNX_ID

MNXM4383

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₁₄H₁₂O₃S₂

charge

mass

292.02279

reference

InChIKey

PNRXZPUOVXRYEX-UHFFFAOYSA-N

InChI

InChI=1S/C14H12O3S2/c1-10(15)17-9-11(16)4-5-12-6-7-14(19-12)13-3-2-8-18-13/h2-3,6-8,11,16H,9H2,1H3

SMILES

CC(=O)OCC(O)C#Cc1ccc(-c2cccs2)s1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:17229 chebi:17229	5-(3-hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene 1-acetoxy-4-[2,2']bithiophenyl-5-ylbut-3-yn-2-ol 4-(2,2'-bithien-5-yl)-2-hydroxybut-3-yn-1-yl acetate 5-(3-Hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene
kegg.compound:C04711 keggC:C04711	5-(3-Hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene
seed.compound:cpd02868 seedM:cpd02868	5-(3-Hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene 5-(3-hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene
metacyc.compound:5-3-HYDROXY-4-ACETOXYBUT-1-YNYL-22-B metacycM:5-3-HYDROXY-4-ACETOXYBUT-1-YNYL-22-B	5-(3-hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene
chebi:12089 chebi:2017 chebi:20525 keggC:M_C04711 seedM:M_cpd02868	secondary/obsolete/fantasy identifier