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CHEBI:44567 - (3R,4S,5S,6R)-2,7-dibenzyl-3,6-bisphenoxymethyl-1,2,7-thiadiazepane-4,5-diol 1,1-dioxide

ChEBI IDCHEBI:44567
ChEBI Name(3R,4S,5S,6R)-2,7-dibenzyl-3,6-bisphenoxymethyl-1,2,7-thiadiazepane-4,5-diol 1,1-dioxide
Stars
ASCII Name(3R,4S,5S,6R)-2,7-dibenzyl-3,6-bisphenoxymethyl-1,2,7-thiadiazepane-4,5-diol 1,1-dioxide
Last Modified17 October 2009
DownloadsMolfile
FormulaC32H34N2O6S
Net Charge0
Average Mass574.699
Monoisotopic Mass574.21376
SMILES[H]O[C@]1([H])[C@@]([H])(O[H])[C@@]([H])(C([H])([H])Oc2c([H])c([H])c([H])c([H])c2[H])N(C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])S(=O)(=O)N(C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])[C@]1([H])C([H])([H])Oc1c([H])c([H])c([H])c([H])c1[H]
InChIInChI=1S/C32H34N2O6S/c35-31-29(23-39-27-17-9-3-10-18-27)33(21-25-13-5-1-6-14-25)41(37,38)34(22-26-15-7-2-8-16-26)30(32(31)36)24-40-28-19-11-4-12-20-28/h1-20,29-32,35-36H,21-24H2/t29-,30-,31+,32+/m1/s1
InChIKeyCAGHBXQSDLNCES-ZRTHHSRSSA-N
ChEBI Ontology
Outgoing Relation(s)
(3R,4S,5S,6R)-2,7-dibenzyl-3,6-bisphenoxymethyl-1,2,7-thiadiazepane-4,5-diol 1,1-dioxide (CHEBI:44567) is a sulfuric amide (CHEBI:38038)
(3R,4S,5S,6R)-2,7-dibenzyl-3,6-bisphenoxymethyl-1,2,7-thiadiazepane-4,5-diol 1,1-dioxide (CHEBI:44567) is a sultam (CHEBI:46950)
(3R,4S,5S,6R)-2,7-dibenzyl-3,6-bisphenoxymethyl-1,2,7-thiadiazepane-4,5-diol 1,1-dioxide (CHEBI:44567) is a thiadiazepane (CHEBI:46949)
Synonyms  Source
2,7-DIBENZYL-1,1-DIOXO-3,6-BIS-PHENOXYMETHYL-[1,2,7]THIADIAZEPANE-4,5-DIOLPDBeChem
(3R,4S,5S,6R)-2,7-dibenzyl-3,6-bis(phenoxymethyl)-1,2,7-thiadiazepane-4,5-diol 1,1-dioxidePDBeChem
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