(3R,4R)-1-[(1S)-carboxy-2-(methylsulfinyl)ethyl]-3-[(5S)-5-amino-5-carboxypentanamido]-4-sulfanylazetidin-2-one (CHEBI:40580)

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CHEBI:40580 - (3R,4R)-1-[(1S)-carboxy-2-(methylsulfinyl)ethyl]-3-[(5S)-5-amino-5-carboxypentanamido]-4-sulfanylazetidin-2-one

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ChEBI ID	CHEBI:40580
ChEBI Name	(3R,4R)-1-[(1S)-carboxy-2-(methylsulfinyl)ethyl]-3-[(5S)-5-amino-5-carboxypentanamido]-4-sulfanylazetidin-2-one
Stars
ASCII Name	(3R,4R)-1-[(1S)-carboxy-2-(methylsulfinyl)ethyl]-3-[(5S)-5-amino-5-carboxypentanamido]-4-sulfanylazetidin-2-one
Last Modified	16 May 2008
Downloads	Molfile

Formula	C13H21N3O7S2
Net Charge	0
Average Mass	395.459
Monoisotopic Mass	395.08209
SMILES	[H]OC(=O)[C@@]([H])(N([H])[H])C([H])([H])C([H])([H])C([H])([H])C(=O)N([H])[C@]1([H])C(=O)N([C@@]([H])(C(=O)O[H])C([H])([H])[S@](=O)C([H])([H])[H])[C@]1([H])S[H]
InChI	InChI=1S/C13H21N3O7S2/c1-25(23)5-7(13(21)22)16-10(18)9(11(16)24)15-8(17)4-2-3-6(14)12(19)20/h6-7,9,11,24H,2-5,14H2,1H3,(H,15,17)(H,19,20)(H,21,22)/t6-,7+,9+,11+,25+/m0/s1
InChIKey	UFLVUEXXBDLOEJ-PESMXUNJSA-N

ChEBI Ontology

Outgoing Relation(s)
	(3R,4R)-1-[(1S)-carboxy-2-(methylsulfinyl)ethyl]-3-[(5S)-5-amino-5-carboxypentanamido]-4-sulfanylazetidin-2-one (CHEBI:40580) is a azetidines (CHEBI:38777)
	(3R,4R)-1-[(1S)-carboxy-2-(methylsulfinyl)ethyl]-3-[(5S)-5-amino-5-carboxypentanamido]-4-sulfanylazetidin-2-one (CHEBI:40580) is a dicarboxylic acid (CHEBI:35692)

Synonyms	Source
1-[(1S)-CARBOXY-2-(METHYLSULFINYL)ETHYL]-(3R)-[(5S)-5-AMINO-5-CARBOXYPENTANAMIDO]-(4R)-SULFANYLAZETIDIN-2-ONE	PDBeChem
N~6~-[(3R,4R)-1-{(1S)-1-carboxy-2-[(S)-methylsulfinyl]ethyl}-2-oxo-4-sulfanylazetidin-3-yl]-6-oxo-L-lysine	PDBeChem

Manual Xrefs	Databases
ACS	PDBeChem