EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:102576 - 2-[(3R,6aR,8R,10aR)-3-hydroxy-1,2,3,4,6,6a,8,9,10,10a-decahydropyrano[2,3-c][1,5]oxazocin-8-yl]-N-(2,3-dihydro-1H-inden-2-yl)acetamide

Default Structure
ChEBI IDCHEBI:102576
ChEBI Name2-[(3R,6aR,8R,10aR)-3-hydroxy-1,2,3,4,6,6a,8,9,10,10a-decahydropyrano[2,3-c][1,5]oxazocin-8-yl]-N-(2,3-dihydro-1H-inden-2-yl)acetamide
Stars
DownloadsMolfile
FormulaC20H28N2O4
Net Charge0
Average Mass360.454
Monoisotopic Mass360.20491
SMILESO=C(C[C@H]1CC[C@H]2NC[C@@H](O)COC[C@@H]2O1)NC1Cc2ccccc2C1
InChIInChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17-,18-,19+/m1/s1
InChIKeyVINMFOKKSKWMTO-MKXGPGLRSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(3R,6aR,8R,10aR)-3-hydroxy-1,2,3,4,6,6a,8,9,10,10a-decahydropyrano[2,3-c][1,5]oxazocin-8-yl]-N-(2,3-dihydro-1H-inden-2-yl)acetamide (CHEBI:102576) is a indanes (CHEBI:46940)
Manual XrefsDatabases
LSM-13923LINCS