CHEBI:94397 - 2-naphthalenesulfonic acid propanoic acid [4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] ester

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ChEBI Name 2-naphthalenesulfonic acid propanoic acid [4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] ester
ChEBI ID CHEBI:94397
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C32H37NO5S
Net Charge 0
Average Mass 547.707
Monoisotopic Mass 547.23924
InChI InChI=1S/C22H29NO2.C10H8O3S/c1-5-21(24)25-22(18(2)17-23(3)4,20-14-10-7-11-15-20)16-19-12-8-6-9-13-19;11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10/h6-15,18H,5,16-17H2,1-4H3;1-7H,(H,11,12,13)
InChIKey VZPXFHVJUUSVLH-UHFFFAOYSA-N
SMILES CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN(C)C.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O
ChEBI Ontology
Outgoing 2-naphthalenesulfonic acid propanoic acid [4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] ester (CHEBI:94397) is a stilbenoid (CHEBI:26776)
Manual Xref Database
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