General Information of Drug (ID: DMLUDO8)

Drug Name
Isosulfan blue
Synonyms
ISOSULFAN BLUE; Sulphan Blue; Sulfanblau; Disulphin Blau; Patentblau V; Patent blau V; 68238-36-8; Isosulfan blue [USAN]; Iso-sulfan blue; UNII-39N9K8S2A4; Sulphan blue 2,5-disulfophenyl isomer; LYMPHAZURIN; P 4125; P 1888; 39N9K8S2A4; Isosulfan blue (USAN); (4-(alpha-(p-(Diethylamino)phenyl)-2,5-disulfobenzylidene)-2,5-cyclohexadien-1-ylidene)diethylammonium hydroxide, inner salt, sodium salt; P-4125; Ethanaminium, N-(4-((4-(diethylamino)phenyl)(2,5-disulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-ethyl-, hydroxide,
Indication
Disease Entry ICD 11 Status REF
Investigative surgical procedure QB8Z Approved [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
Chemical Identifiers
Formula
C27H31N2NaO6S2
Canonical SMILES
CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=C(C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]
InChI
InChI=1S/C27H32N2O6S2.Na/c1-5-28(6-2)22-13-9-20(10-14-22)27(21-11-15-23(16-12-21)29(7-3)8-4)25-19-24(36(30,31)32)17-18-26(25)37(33,34)35;/h9-19H,5-8H2,1-4H3,(H-,30,31,32,33,34,35);/q;+1/p-1
InChIKey
NLUFDZBOHMOBOE-UHFFFAOYSA-M
Cross-matching ID
PubChem CID
50108
CAS Number
68238-36-8
UNII
NS6Q291771
DrugBank ID
DB09136
TTD ID
D0P2YD
Drug ADMET Endpoint Profile (DAE)NEW Click to Jump to the Detailed DAE Information of This Drug
Combinatorial Drugs (CBD) Click to Jump to the Detailed CBD Information of This Drug

References

1 Drugs@FDA. U.S. Food and Drug Administration. U.S. Department of Health & Human Services. 2015