CHEBI:104947 - 9H-xanthene-9-carboxylic acid [2-[(1,1-dioxo-3-thiolanyl)-methylamino]-2-oxoethyl] ester

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ChEBI Name 9H-xanthene-9-carboxylic acid [2-[(1,1-dioxo-3-thiolanyl)-methylamino]-2-oxoethyl] ester
ChEBI ID CHEBI:104947
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H21NO6S
Net Charge 0
Average Mass 415.461
Monoisotopic Mass 415.10896
InChI InChI=1S/C21H21NO6S/c1-22(14-10-11-29(25,26)13-14)19(23)12-27-21(24)20-15-6-2-4-8-17(15)28-18-9-5-3-7-16(18)20/h2-9,14,20H,10-13H2,1H3
InChIKey OEVTZSJQEOGMBK-UHFFFAOYSA-N
SMILES CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24
ChEBI Ontology
Outgoing 9H-xanthene-9-carboxylic acid [2-[(1,1-dioxo-3-thiolanyl)-methylamino]-2-oxoethyl] ester (CHEBI:104947) is a xanthenes (CHEBI:38835)
Manual Xref Database
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