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CHEBI:41020 - 2,5-DIBENZYLOXY-3,4-DIHYDROXY-HEXANEDIOIC ACID BENZYLAMIDE (2-HYDROXY-INDAN-1-YL)-AMIDE

Default Structure
ChEBI IDCHEBI:41020
ChEBI Name2,5-DIBENZYLOXY-3,4-DIHYDROXY-HEXANEDIOIC ACID BENZYLAMIDE (2-HYDROXY-INDAN-1-YL)-AMIDE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC36H38N2O7
Net Charge0
Average Mass610.707
Monoisotopic Mass610.26790
SMILES[H]O[C@]([H])([C@@]([H])(O[H])[C@@]([H])(OC([H])([H])c1c([H])c([H])c([H])c([H])c1[H])C(=O)N([H])[C@@]1([H])c2c([H])c([H])c([H])c([H])c2C([H])([H])[C@@]1([H])O[H])[C@@]([H])(OC([H])([H])c1c([H])c([H])c([H])c([H])c1[H])C(=O)N([H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H]
InChIInChI=1S/C36H38N2O7/c39-29-20-27-18-10-11-19-28(27)30(29)38-36(43)34(45-23-26-16-8-3-9-17-26)32(41)31(40)33(44-22-25-14-6-2-7-15-25)35(42)37-21-24-12-4-1-5-13-24/h1-19,29-34,39-41H,20-23H2,(H,37,42)(H,38,43)/t29-,30+,31-,32-,33-,34-/m1/s1
InChIKeyKMCYORONTQQGJB-VQEIZDKSSA-N
ChEBI Ontology
Outgoing Relation(s)
2,5-DIBENZYLOXY-3,4-DIHYDROXY-HEXANEDIOIC ACID BENZYLAMIDE (2-HYDROXY-INDAN-1-YL)-AMIDE (CHEBI:41020) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2,5-DIBENZYLOXY-3,4-DIHYDROXY-HEXANEDIOIC ACID BENZYLAMIDE (2-HYDROXY-INDAN-1-YL)-AMIDEPDBeChem
(2R,3R,4R,5R)-N-benzyl-2,5-bis(benzyloxy)-3,4-dihydroxy-N'-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]hexanediamide (non-preferred name)PDBeChem
Manual XrefsDatabases
BEHPDBeChem