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CHEBI:42765 - 4-ACETYL-4-GUANIDINO-6-METHYL(PROPYL)CARBOXAMIDE-4,5-DIHYDRO-2H-PYRAN-2-CARBOXYLIC ACID

Default Structure
ChEBI IDCHEBI:42765
ChEBI Name4-ACETYL-4-GUANIDINO-6-METHYL(PROPYL)CARBOXAMIDE-4,5-DIHYDRO-2H-PYRAN-2-CARBOXYLIC ACID
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC14H23N5O5
Net Charge0
Average Mass341.368
Monoisotopic Mass341.16992
SMILES[H]/N=C(\N([H])[H])N([H])[C@@]1([H])C([H])=C(C(=O)O[H])O[C@@]([H])(C(=O)N(C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])[H])[C@]1([H])N([H])C(=O)C([H])([H])[H]
InChIInChI=1S/C14H23N5O5/c1-4-5-19(3)12(21)11-10(17-7(2)20)8(18-14(15)16)6-9(24-11)13(22)23/h6,8,10-11H,4-5H2,1-3H3,(H,17,20)(H,22,23)(H4,15,16,18)/t8-,10+,11+/m0/s1
InChIKeyQPJWMZVTNXFTKV-JMJZKYOTSA-N
ChEBI Ontology
Outgoing Relation(s)
4-ACETYL-4-GUANIDINO-6-METHYL(PROPYL)CARBOXAMIDE-4,5-DIHYDRO-2H-PYRAN-2-CARBOXYLIC ACID (CHEBI:42765) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(2R,3R,4S)-3-(acetylamino)-4-carbamimidamido-2-[methyl(propyl)carbamoyl]-3,4-dihydro-2H-pyran-6-carboxylic acid (non-preferred name)PDBeChem
4-ACETYL-4-GUANIDINO-6-METHYL(PROPYL)CARBOXAMIDE-4,5-DIHYDRO-2H-PYRAN-2-CARBOXYLIC ACIDPDBeChem
Manual XrefsDatabases
G20PDBeChem