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CHEBI:39880 - {4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)-3-OXOPROPYL]PHENYL}SULFAMIC ACID

Default Structure
ChEBI IDCHEBI:39880
ChEBI Name{4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)-3-OXOPROPYL]PHENYL}SULFAMIC ACID
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC19H21NO7S
Net Charge0
Average Mass407.444
Monoisotopic Mass407.10387
SMILES[H]OS(=O)(=O)N([H])c1c([H])c([H])c(C([H])([H])C(C(=O)OC([H])([H])[H])(C(=O)OC([H])([H])[H])C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H]
InChIInChI=1S/C19H21NO7S/c1-26-17(21)19(18(22)27-2,12-14-6-4-3-5-7-14)13-15-8-10-16(11-9-15)20-28(23,24)25/h3-11,20H,12-13H2,1-2H3,(H,23,24,25)
InChIKeySUACYXRSGYYBGT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
{4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)-3-OXOPROPYL]PHENYL}SULFAMIC ACID (CHEBI:39880) is a unclassifieds (CHEBI:27189)
Synonyms  Source
{4-[2-benzyl-3-methoxy-2-(methoxycarbonyl)-3-oxopropyl]phenyl}sulfamic acidPDBeChem
{4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)-3-OXOPROPYL]PHENYL}SULFAMIC ACIDPDBeChem
Manual XrefsDatabases
2UNPDBeChem