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debrisoquin sulfate

Properties

Image

Occurences in reactions

MNX_ID

MNXM104255

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₀H₂₈N₆O₄S

charge

mass

448.18927

reference

InChIKey

CAYGYVYWRIHZCQ-UHFFFAOYSA-N

InChI

InChI=1S/2C10H13N3.H2O4S/c2*11-10(12)13-6-5-8-3-1-2-4-9(8)7-13;1-5(2,3)4/h2*1-4H,5-7H2,(H3,11,12);(H2,1,2,3,4)

SMILES

N=C(N)N1CCc2ccccc2C1.N=C(N)N1CCc2ccccc2C1.O=S(=O)([O-])[O-].[H+].[H+]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:50973 chebi:50973	debrisoquin sulfate 1,2,3,4-Tetrahydro-isoquinoline-2-carboxamidine sulfate 2(1H)-Isoquinolinecarboximidamide, 3,4-dihydro-, sulfate(2:1) Debrisoquin hemisulfate Isocaramidine sulfate bis(3,4-dihydroisoquinoline-2(1H)-carboximidamide) sulfate
kegg.drug:D03664 keggD:D03664	Debrisoquin sulfate (USAN) Declinax (TN)
keggD:M_D03664	secondary/obsolete/fantasy identifier