3-carboxy-4-hydroxy-3-(hydroxymethyl)-4-oxo-butanoate; diethyl-[2-[2-[(8R,9R)-9-phenyl7,10-dioxabicyclo[4.4.0]deca-1,3,5-triene-8-carbonyl]oxyethoxy]ethyl]azanium
Molecular Formula:
C29H37NO12
InChI: InChI=1/C23H29NO5.C6H8O7/c1-3-24(4-2)14-15-26-16-17-27-23(25)22-21(18-10-6-5-7-11-18)28-19-12-8-9-13-20(19)29-22;7-2-6(4(10)11,5(12)13)1-3(8)9/h5-13,21-22H,3-4,14-17H2,1-2H3;7H,1-2H2,(H,8,9)(H,10,11)(H,12,13)/t21-,22+;/m0./s1/fC23H30NO5.C6H7O7/h24H;10,12H/q+1;-1
InChIKey: InChIKey=YNNGGPDVBSEGQX-DFFJNBGDDW
SMILES: CC[NH+](CC)CCOCCOC(=O)C1C(OC2=CC=CC=C2O1)C3=CC=CC=C3.C(C(=O)[O-])C(CO)(C(=O)O)C(=O)O
Names:
1,4-Benzodioxan-2-carboxylic acid, 3-phenyl-, 2-(2-(diethylamino)ethoxy)ethyl ester, citrate, (E)-
1,4-BENZODIOXAN-2-CARBOXYLIC ACID, 3-PHENYL-, 2-(2-(DIETHYLAMINO)ETHOXY)ETHYL ES
100447-55-0
3-carboxy-4-hydroxy-3-(hydroxymethyl)-4-oxo-butanoate; diethyl-[2-[2-[(8R,9R)-9-phenyl7,10-dioxabicyclo[4.4.0]deca-1,3,5-triene-8-carbonyl]oxyethoxy]ethyl]azanium
Registries:
PubChem CID 57863
PubChem ID 194838
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