(2S,3R)-N-[5-chloro-2-(2,3-dihydro-1H-tetrazol-1-yl)benzyl]-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl]amino}-1-phenylbutan-2-aminium (CHEBI:47296)

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CHEBI:47296 - (2S,3R)-N-[5-chloro-2-(2,3-dihydro-1H-tetrazol-1-yl)benzyl]-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl]amino}-1-phenylbutan-2-aminium

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ChEBI ID	CHEBI:47296
ChEBI Name	(2S,3R)-N-[5-chloro-2-(2,3-dihydro-1H-tetrazol-1-yl)benzyl]-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl]amino}-1-phenylbutan-2-aminium
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Downloads	Molfile

Formula	C25H30ClN6O4S
Net Charge	+1
Average Mass	546.073
Monoisotopic Mass	545.17323
SMILES	[H]O[C@]([H])(C([H])([H])N([H])S(=O)(=O)c1c([H])c([H])c(OC([H])([H])[H])c([H])c1[H])[C@]([H])(C([H])([H])c1c([H])c([H])c([H])c([H])c1[H])[N+]([H])([H])C([H])([H])c1c([H])c(Cl)c([H])c([H])c1N1C([H])=NN([H])N1[H]
InChI	InChI=1S/C25H29ClN6O4S/c1-36-21-8-10-22(11-9-21)37(34,35)29-16-25(33)23(13-18-5-3-2-4-6-18)27-15-19-14-20(26)7-12-24(19)32-17-28-30-31-32/h2-12,14,17,23,25,27,29-31,33H,13,15-16H2,1H3/p+1/t23-,25+/m0/s1
InChIKey	LMFQPEFBZUDVPR-UKILVPOCSA-O

ChEBI Ontology

Outgoing Relation(s)
	(2S,3R)-N-[5-chloro-2-(2,3-dihydro-1H-tetrazol-1-yl)benzyl]-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl]amino}-1-phenylbutan-2-aminium (CHEBI:47296) is a unclassifieds (CHEBI:27189)

Synonym	Source
(2S,3R)-N-[5-chloro-2-(2,3-dihydro-1H-tetrazol-1-yl)benzyl]-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl]amino}-1-phenylbutan-2-aminium	PDBeChem

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