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Details

Stereochemistry ACHIRAL
Molecular Formula C27H21NO8
Molecular Weight 487.4575
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,3'-((4-(DIMETHYLAMINO)PHENYL)METHYLENE)BIS(4,7-DIHYDROXY-2H-CHROMEN-2-ONE)

SMILES

CN(C)C1=CC=C(C=C1)C(C2=C(O)C3=C(OC2=O)C=C(O)C=C3)C4=C(O)C5=C(OC4=O)C=C(O)C=C5

InChI

InChIKey=WCIMSRXMXDJFGX-UHFFFAOYSA-N
InChI=1S/C27H21NO8/c1-28(2)14-5-3-13(4-6-14)21(22-24(31)17-9-7-15(29)11-19(17)35-26(22)33)23-25(32)18-10-8-16(30)12-20(18)36-27(23)34/h3-12,21,29-32H,1-2H3

HIDE SMILES / InChI

Molecular Formula C27H21NO8
Molecular Weight 487.4575
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 12:45:30 GMT 2023
Edited
by admin
on Sat Dec 16 12:45:30 GMT 2023
Record UNII
I00LTL14N9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,3'-((4-(DIMETHYLAMINO)PHENYL)METHYLENE)BIS(4,7-DIHYDROXY-2H-CHROMEN-2-ONE)
Systematic Name English
COUMARIN, 3,3'-(P-(DIMETHYLAMINO)BENZYLIDENE)BIS(4,7-DIHYDROXY-
Systematic Name English
NSC-33587
Code English
Code System Code Type Description
PUBCHEM
54690692
Created by admin on Sat Dec 16 12:45:30 GMT 2023 , Edited by admin on Sat Dec 16 12:45:30 GMT 2023
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NSC
33587
Created by admin on Sat Dec 16 12:45:30 GMT 2023 , Edited by admin on Sat Dec 16 12:45:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID10211706
Created by admin on Sat Dec 16 12:45:30 GMT 2023 , Edited by admin on Sat Dec 16 12:45:30 GMT 2023
PRIMARY
CAS
6265-51-6
Created by admin on Sat Dec 16 12:45:30 GMT 2023 , Edited by admin on Sat Dec 16 12:45:30 GMT 2023
PRIMARY
FDA UNII
I00LTL14N9
Created by admin on Sat Dec 16 12:45:30 GMT 2023 , Edited by admin on Sat Dec 16 12:45:30 GMT 2023
PRIMARY