The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
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Preferred Name

meropenem trihydrate
Synonyms

C17H25N3O5S.3H2O

(6S)-2-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-6-[(1R)-1-hydroxyethyl]-1beta-methyl-2,3-didehydro-1-carbapenam-3-carboxylic acid--water (1:3)

Meronem

Merrem
ID

http://purl.obolibrary.org/obo/CHEBI_6770
Definition

A hydrate that has formula C17H25N3O5S.3H2O.
has role

http://purl.obolibrary.org/obo/CHEBI_36047
InChI

InChI=1S/C17H25N3O5S.3H2O/c1-7-12-11(8(2)21)16(23)20(12)13(17(24)25)14(7)26-9-5-10(18-6-9)15(22)19(3)4;;;/h7-12,18,21H,5-6H2,1-4H3,(H,24,25);3*1H2/t7-,8-,9+,10+,11-,12-;;;/m1.../s1
InChIKey

InChIKey=CTUAQTBUVLKNDJ-OBZXMJSBSA-N
label

meropenem trihydrate
prefixIRI

obo2:CHEBI_6770
prefLabel

meropenem trihydrate
SMILES

[H]O[H].[H]O[H].[H]O[H].[H][C@]12[C@@H](C)C(S[C@@H]3CN[C@@H](C3)C(=O)N(C)C)=C(N1C(=O)[C@]2([H])[C@@H](C)O)C(O)=O
Synonym

C17H25N3O5S.3H2O

(6S)-2-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-6-[(1R)-1-hydroxyethyl]-1beta-methyl-2,3-didehydro-1-carbapenam-3-carboxylic acid--water (1:3)

Meronem

Merrem
xref

KEGG DRUG:D02222

CASRN:119478-56-7

DrugBank:DB00760
subClassOf

http://purl.obolibrary.org/obo/dinto_000055
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