U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C44H32N4O6S2
Molecular Weight 776.878
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FIMAPORFIN A

SMILES

OS(=O)(=O)C1=CC=C(C=C1)C2=C3NC(C=C3)=C(C4=NC(C=C4)=C(C5=CC=C(N5)C(=C6CCC2=N6)C7=CC=C(C=C7)S(O)(=O)=O)C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChIKey=MVBCOYVJSZKRIV-JAAFTSFNSA-N
InChI=1S/C44H32N4O6S2/c49-55(50,51)31-15-11-29(12-16-31)43-37-23-21-35(46-37)41(27-7-3-1-4-8-27)33-19-20-34(45-33)42(28-9-5-2-6-10-28)36-22-24-38(47-36)44(40-26-25-39(43)48-40)30-13-17-32(18-14-30)56(52,53)54/h1-24,46-47H,25-26H2,(H,49,50,51)(H,52,53,54)/b41-33-,41-35-,42-34-,42-36-,43-37-,43-39-,44-38-,44-40-

HIDE SMILES / InChI

Approval Year

Name Type Language
FIMAPORFIN A
Common Name English
4,4'-(15,20-DIPHENYL-7,8-DIHYDRO- 21H,23H-PORPHINE-5,10-DIYL)BISBENZENESULFONIC ACID
Systematic Name English
TPCS2A
Common Name English
BENZENESULFONIC ACID, 4,4'-(7,8-DIHYDRO-15,20-DIPHENYL-21H,23H-PORPHINE-5,10-DIYL)BIS-
Systematic Name English
Code System Code Type Description
NCI_THESAURUS
C88344
Created by admin on Sat Dec 16 08:20:41 GMT 2023 , Edited by admin on Sat Dec 16 08:20:41 GMT 2023
PRIMARY
SMS_ID
100000175840
Created by admin on Sat Dec 16 08:20:41 GMT 2023 , Edited by admin on Sat Dec 16 08:20:41 GMT 2023
PRIMARY
CAS
501083-97-2
Created by admin on Sat Dec 16 08:20:41 GMT 2023 , Edited by admin on Sat Dec 16 08:20:41 GMT 2023
PRIMARY
FDA UNII
P4BBY8S91N
Created by admin on Sat Dec 16 08:20:41 GMT 2023 , Edited by admin on Sat Dec 16 08:20:41 GMT 2023
PRIMARY
EVMPD
SUB190357
Created by admin on Sat Dec 16 08:20:41 GMT 2023 , Edited by admin on Sat Dec 16 08:20:41 GMT 2023
PRIMARY
PUBCHEM
44177671
Created by admin on Sat Dec 16 08:20:41 GMT 2023 , Edited by admin on Sat Dec 16 08:20:41 GMT 2023
PRIMARY