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CHEBI:93776 - sulfamic acid [4-[4-(2,3-dihydro-1H-inden-1-ylamino)-7-pyrrolo[2,3-d]pyrimidinyl]-2-hydroxycyclopentyl]methyl ester

Default Structure
ChEBI IDCHEBI:93776
ChEBI Namesulfamic acid [4-[4-(2,3-dihydro-1H-inden-1-ylamino)-7-pyrrolo[2,3-d]pyrimidinyl]-2-hydroxycyclopentyl]methyl ester
Stars
DownloadsMolfile
FormulaC21H25N5O4S
Net Charge0
Average Mass443.529
Monoisotopic Mass443.16273
SMILESNS(=O)(=O)OCC1CC(n2ccc3c(NC4CCc5ccccc54)ncnc32)CC1O
InChIInChI=1S/C21H25N5O4S/c22-31(28,29)30-11-14-9-15(10-19(14)27)26-8-7-17-20(23-12-24-21(17)26)25-18-6-5-13-3-1-2-4-16(13)18/h1-4,7-8,12,14-15,18-19,27H,5-6,9-11H2,(H2,22,28,29)(H,23,24,25)
InChIKeyMPUQHZXIXSTTDU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
sulfamic acid [4-[4-(2,3-dihydro-1H-inden-1-ylamino)-7-pyrrolo[2,3-d]pyrimidinyl]-2-hydroxycyclopentyl]methyl ester (CHEBI:93776) is a indanes (CHEBI:46940)
Manual XrefsDatabases
LSM-4286LINCS