Home > Products > Screening Compounds P78360 > Monoanhydride with sulfuric acid

Monoanhydride with sulfuric acid

Catalog Number: EVT-1535908

CAS Number: 38989-37-6

Molecular Formula: C24H25NO9S

Molecular Weight: 503.5 g/mol

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Product Introduction

Properties

CAS Number

38989-37-6

Product Name

Monoanhydride with sulfuric acid

IUPAC Name

2-sulfoacetate;2,3,10,11-tetramethoxy-8-methylisoquinolino[2,1-b]isoquinolin-7-ium

Molecular Formula

C24H25NO9S

Molecular Weight

503.5 g/mol

InChI

InChI=1S/C22H22NO4.C2H4O5S/c1-13-16-11-21(26-4)20(25-3)10-15(16)8-18-17-12-22(27-5)19(24-2)9-14(17)6-7-23(13)18;3-2(4)1-8(5,6)7/h6-12H,1-5H3;1H2,(H,3,4)(H,5,6,7)/q+1;/p-1

InChI Key

KRPNDEFBHRAWPW-UHFFFAOYSA-M

SMILES

CC1=C2C=C(C(=CC2=CC3=[N+]1C=CC4=CC(=C(C=C43)OC)OC)OC)OC.C(C(=O)[O-])S(=O)(=O)O

Synonyms

coralyne
coralyne acetosulfate
coralyne chloride
coralyne sulfoacetate
NSC-154890

Canonical SMILES

CC1=C2C=C(C(=CC2=CC3=[N+]1C=CC4=CC(=C(C=C43)OC)OC)OC)OC.C(C(=O)O)S(=O)(=O)[O-]

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