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Details

Stereochemistry ACHIRAL
Molecular Formula C20H15NO8S2
Molecular Weight 461.465
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RHODULINE ACID

SMILES

OC1=CC(=CC2=CC(NC3=CC4=CC(=CC(O)=C4C=C3)S(O)(=O)=O)=CC=C12)S(O)(=O)=O

InChI

InChIKey=BQVLLTHCZQAJNH-UHFFFAOYSA-N
InChI=1S/C20H15NO8S2/c22-19-9-15(30(24,25)26)7-11-5-13(1-3-17(11)19)21-14-2-4-18-12(6-14)8-16(10-20(18)23)31(27,28)29/h1-10,21-23H,(H,24,25,26)(H,27,28,29)

HIDE SMILES / InChI

Molecular Formula C20H15NO8S2
Molecular Weight 461.465
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:58:53 GMT 2023
Edited
by admin
on Sat Dec 16 11:58:53 GMT 2023
Record UNII
EB8FE6GXT2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RHODULINE ACID
Common Name English
NSC-1698
Code English
7,7'-IMINOBIS(4-HYDROXY-2-NAPHTHALENESULFONIC ACID)
Systematic Name English
2-NAPHTHALENESULFONIC ACID, 7,7'-IMINOBIS(4-HYDROXY-
Systematic Name English
4,4'-DIHYDROXY-7,7'-IMINODI(NAPHTHALENE-2-SULPHONIC ACID)
Systematic Name English
7,7'-IMINOBIS(4-HYDROXY-2-NAPHTHALENESULPHONIC ACID)
Systematic Name English
4,4'-DIHYDROXY-7,7'-IMINODI(NAPHTHALENE-2-SULFONIC ACID)
Systematic Name English
2-NAPHTHALENESULPHONIC ACID, 7,7'-IMINOBIS(4-HYDROXY-
Systematic Name English
Code System Code Type Description
CAS
87-03-6
Created by admin on Sat Dec 16 11:58:53 GMT 2023 , Edited by admin on Sat Dec 16 11:58:53 GMT 2023
PRIMARY
PUBCHEM
66594
Created by admin on Sat Dec 16 11:58:53 GMT 2023 , Edited by admin on Sat Dec 16 11:58:53 GMT 2023
PRIMARY
EPA CompTox
DTXSID8058952
Created by admin on Sat Dec 16 11:58:53 GMT 2023 , Edited by admin on Sat Dec 16 11:58:53 GMT 2023
PRIMARY
NSC
1698
Created by admin on Sat Dec 16 11:58:53 GMT 2023 , Edited by admin on Sat Dec 16 11:58:53 GMT 2023
PRIMARY
FDA UNII
EB8FE6GXT2
Created by admin on Sat Dec 16 11:58:53 GMT 2023 , Edited by admin on Sat Dec 16 11:58:53 GMT 2023
PRIMARY
ECHA (EC/EINECS)
201-719-4
Created by admin on Sat Dec 16 11:58:53 GMT 2023 , Edited by admin on Sat Dec 16 11:58:53 GMT 2023
PRIMARY