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CHEBI:44761 - PACTAMYCIN

Default Structure
ChEBI IDCHEBI:44761
ChEBI NamePACTAMYCIN
Stars
Last Modified2 December 2009
DownloadsMolfile
FormulaC28H38N4O8
Net Charge0
Average Mass558.632
Monoisotopic Mass558.26896
SMILES[H]Oc1c([H])c([H])c([H])c(C([H])([H])[H])c1C(=O)OC([H])([H])[C@@]1(O[H])[C@@]([H])(N([H])c2c([H])c([H])c([H])c(C(=O)C([H])([H])[H])c2[H])[C@]([H])(N([H])[H])[C@@](N([H])C(=O)N(C([H])([H])[H])C([H])([H])[H])([C@@]([H])(O[H])C([H])([H])[H])[C@]1(O[H])C([H])([H])[H]
InChIInChI=1S/C28H38N4O8/c1-15-9-7-12-20(35)21(15)24(36)40-14-27(39)23(30-19-11-8-10-18(13-19)16(2)33)22(29)28(17(3)34,26(27,4)38)31-25(37)32(5)6/h7-13,17,22-23,30,34-35,38-39H,14,29H2,1-6H3,(H,31,37)/t17-,22-,23-,26-,27+,28-/m0/s1
InChIKeyWVIUOSJLUCTGFK-JUJPXXQGSA-N
ChEBI Ontology
Outgoing Relation(s)
PACTAMYCIN (CHEBI:44761) is a unclassifieds (CHEBI:27189)
Synonyms  Source
{(1S,2R,3R,4S,5S)-5-[(3-acetylphenyl)amino]-4-amino-3-[(dimethylcarbamoyl)amino]-1,2-dihydroxy-3-[(1S)-1-hydroxyethyl]-2-methylcyclopentyl}methyl 2-hydroxy-6-methylbenzoatePDBeChem
PACTAMYCINPDBeChem
Manual XrefsDatabases
PCYPDBeChem