4-[[[(2S,3R,5aS,10aS)-3-(4-hydroxyphenyl)-5,10-dioxo-1,2,3,5a,6,7,8,10a-octahydrodipyrrolo[1,2-c:1',3'-f]pyrazin-2-yl]-oxomethyl]amino]butyl-trimethylammonium (CHEBI:125266)

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CHEBI:125266 - 4-[[[(2S,3R,5aS,10aS)-3-(4-hydroxyphenyl)-5,10-dioxo-1,2,3,5a,6,7,8,10a-octahydrodipyrrolo[1,2-c:1',3'-f]pyrazin-2-yl]-oxomethyl]amino]butyl-trimethylammonium

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ChEBI ID	CHEBI:125266
ChEBI Name	4-[[[(2S,3R,5aS,10aS)-3-(4-hydroxyphenyl)-5,10-dioxo-1,2,3,5a,6,7,8,10a-octahydrodipyrrolo[1,2-c:1',3'-f]pyrazin-2-yl]-oxomethyl]amino]butyl-trimethylammonium
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Formula	C24H35N4O4
Net Charge	+1
Average Mass	443.568
Monoisotopic Mass	443.26528
SMILES	C[N+](C)(C)CCCCNC(=O)[C@H]1C[C@H]2C(=O)N3CCC[C@H]3C(=O)N2[C@H]1c1ccc(O)cc1
InChI	InChI=1S/C24H34N4O4/c1-28(2,3)14-5-4-12-25-22(30)18-15-20-23(31)26-13-6-7-19(26)24(32)27(20)21(18)16-8-10-17(29)11-9-16/h8-11,18-21H,4-7,12-15H2,1-3H3,(H-,25,29,30)/p+1/t18-,19-,20-,21-/m0/s1
InChIKey	LOBOCHFWHSQCFQ-TUFLPTIASA-O

ChEBI Ontology

Outgoing Relation(s)
	4-[[[(2S,3R,5aS,10aS)-3-(4-hydroxyphenyl)-5,10-dioxo-1,2,3,5a,6,7,8,10a-octahydrodipyrrolo[1,2-c:1',3'-f]pyrazin-2-yl]-oxomethyl]amino]butyl-trimethylammonium (CHEBI:125266) is a pyrrolidines (CHEBI:38260)

Manual Xrefs	Databases
LSM-36736	LINCS