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zofenoprilat

Properties

Image

Occurences in reactions

MNX_ID

MNXM162219

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

formula

C₁₅H₁₉NO₃S₂

charge

mass

325.08064

reference

InChIKey

UQWLOWFDKAFKAP-WXHSDQCUSA-N

InChI

InChI=1S/C15H19NO3S2/c1-10(9-20)14(17)16-8-12(7-13(16)15(18)19)21-11-5-3-2-4-6-11/h2-6,10,12-13,20H,7-9H2,1H3,(H,18,19)/t10-,12+,13+/m1/s1

SMILES

C[C@H](CS)C(=O)N1C[C@@H](Sc2ccccc2)C[C@H]1C(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:82602 chebi:82602	zofenoprilat (4S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]-4-(phenylsulfanyl)-L-proline zofenoprilate zofenoprilatum
kegg.compound:C21576 keggC:C21576	Zofenoprilat
CHEBI:82604 chebi:82604	zofenoprilat(1-) (2S,4S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]-4-(phenylsulfanyl)pyrrolidine-2-carboxylate zofenoprilat anion
keggC:M_C21576	secondary/obsolete/fantasy identifier