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Details

Stereochemistry ACHIRAL
Molecular Formula C40H44N12O10S2
Molecular Weight 916.982
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of FLUORESCENT BRIGHTENER 28, (Z)-

SMILES

OCCN(CCO)C1=NC(NC2=CC=C(\C=C/C3=CC=C(NC4=NC(NC5=CC=CC=C5)=NC(=N4)N(CCO)CCO)C=C3S(O)(=O)=O)C(=C2)S(O)(=O)=O)=NC(NC6=CC=CC=C6)=N1

InChI

InChIKey=CNGYZEMWVAWWOB-QXMHVHEDSA-N
InChI=1S/C40H44N12O10S2/c53-21-17-51(18-22-54)39-47-35(41-29-7-3-1-4-8-29)45-37(49-39)43-31-15-13-27(33(25-31)63(57,58)59)11-12-28-14-16-32(26-34(28)64(60,61)62)44-38-46-36(42-30-9-5-2-6-10-30)48-40(50-38)52(19-23-55)20-24-56/h1-16,25-26,53-56H,17-24H2,(H,57,58,59)(H,60,61,62)(H2,41,43,45,47,49)(H2,42,44,46,48,50)/b12-11-

HIDE SMILES / InChI

Molecular Formula C40H44N12O10S2
Molecular Weight 916.982
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:48:15 UTC 2023
Edited
by admin
on Sat Dec 16 10:48:15 UTC 2023
Record UNII
I2HFX7606W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FLUORESCENT BRIGHTENER 28, (Z)-
Common Name English
CI FLUORESCENT BRIGHTENING AGENT 28, (Z)-
Common Name English
C.I. FLUORESCENT BRIGHTENING AGENT 28, (Z)-
Common Name English
Code System Code Type Description
CAS
17118-44-4
Created by admin on Sat Dec 16 10:48:15 UTC 2023 , Edited by admin on Sat Dec 16 10:48:15 UTC 2023
PRIMARY
FDA UNII
I2HFX7606W
Created by admin on Sat Dec 16 10:48:15 UTC 2023 , Edited by admin on Sat Dec 16 10:48:15 UTC 2023
PRIMARY
PUBCHEM
59121540
Created by admin on Sat Dec 16 10:48:15 UTC 2023 , Edited by admin on Sat Dec 16 10:48:15 UTC 2023
PRIMARY