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

Details

Stereochemistry ACHIRAL
Molecular Formula C45H52N4O14S2
Molecular Weight 937.043
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 3
Charge 0

SHOW SMILES / InChI
Structure of CY-5

SMILES

CC1(C)\C(=C/C=C/C=C/C2=[N+](CCCCCC(=O)ON3C(=O)CCC3=O)C4=C(C=C(C=C4)S([O-])(=O)=O)C2(C)C)N(CCCCCC(=O)ON5C(=O)CCC5=O)C6=C1C=C(C=C6)S(O)(=O)=O

InChI

InChIKey=MGIODCZGPVDROX-UHFFFAOYSA-N
InChI=1S/C45H52N4O14S2/c1-44(2)32-28-30(64(56,57)58)18-20-34(32)46(26-12-6-10-16-42(54)62-48-38(50)22-23-39(48)51)36(44)14-8-5-9-15-37-45(3,4)33-29-31(65(59,60)61)19-21-35(33)47(37)27-13-7-11-17-43(55)63-49-40(52)24-25-41(49)53/h5,8-9,14-15,18-21,28-29H,6-7,10-13,16-17,22-27H2,1-4H3,(H-,56,57,58,59,60,61)

HIDE SMILES / InChI

Molecular Formula C45H52N4O14S2
Molecular Weight 937.043
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 3
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:13:51 GMT 2023
Edited
by admin
on Sat Dec 16 11:13:51 GMT 2023
Record UNII
HSK439WFK4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CY-5
Common Name English
1-(6-((2,5-DIOXOPYRROLIDIN-1-YL)OXY)-6-OXOHEXYL)-2-((1E,3E,5E)-5-(1-(6-((2,5-DIOXOPYRROLIDIN-1-YL)OXY)-6-OXOHEXYL)-3,3-DIMETHYL-5-SULFOINDOLIN-2-YLIDENE)PENTA-1,3-DIEN-1-YL)-3,3-DIMETHYL-3H-INDOL-1-IUM-5-SULFONATE
Systematic Name English
3H-INDOLIUM, 1-(6-((2,5-DIOXO-1-PYRROLIDINYL)OXY)-6-OXOHEXYL)-2-(5-(1-(6-((2,5-DIOXO-1-PYRROLIDINYL)OXY)-6-OXOHEXYL)-1,3-DIHYDRO-3,3-DIMETHYL-5-SULFO-2H-INDOL-2-YLIDENE)-1,3-PENTADIEN-1-YL)-3,3-DIMETHYL-5-SULFO-, INNER SALT
Common Name English
CY5 [MI]
Common Name English
CYANINE DYE-5
Common Name English
Code System Code Type Description
CAS
146368-15-2
Created by admin on Sat Dec 16 11:13:51 GMT 2023 , Edited by admin on Sat Dec 16 11:13:51 GMT 2023
PRIMARY
FDA UNII
HSK439WFK4
Created by admin on Sat Dec 16 11:13:51 GMT 2023 , Edited by admin on Sat Dec 16 11:13:51 GMT 2023
PRIMARY
PUBCHEM
73656934
Created by admin on Sat Dec 16 11:13:51 GMT 2023 , Edited by admin on Sat Dec 16 11:13:51 GMT 2023
PRIMARY
MERCK INDEX
m3939
Created by admin on Sat Dec 16 11:13:51 GMT 2023 , Edited by admin on Sat Dec 16 11:13:51 GMT 2023
PRIMARY