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Details

Stereochemistry ACHIRAL
Molecular Formula C20H19N3O4
Molecular Weight 365.3833
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of INDIRUBIN E804

SMILES

c1ccc2c(c1)/C(=C/3\C(=N/OCCC(CO)O)\c4ccccc4N3)/C(=N2)O

InChI

InChIKey=RKUMZEVCWKZXFV-YQSYOFKPSA-N
InChI=1S/C20H19N3O4/c24-11-12(25)9-10-27-23-18-14-6-2-4-8-16(14)21-19(18)17-13-5-1-3-7-15(13)22-20(17)26/h1-8,12,21,24-25H,9-11H2,(H,22,26)/b19-17-,23-18-

HIDE SMILES / InChI

Molecular Formula C20H19N3O4
Molecular Weight 365.3833
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 04:05:50 UTC 2021
Edited
by admin
on Sat Jun 26 04:05:50 UTC 2021
Record UNII
BYW31FWC1X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
INDIRUBIN E804
Common Name English
3-(3-((3,4-DIHYDROXYBUTOXY)IMINO)-1,3-DIHYDRO-2H-INDOL-2-YLIDENE)-1,3-DIHYDRO-2H-INDOL-2-ONE
Systematic Name English
INDIRUBIN DERIVATIVE E804
Common Name English
2H-INDOL-2-ONE, 3-(3-((3,4-DIHYDROXYBUTOXY)IMINO)-1,3-DIHYDRO-2H-INDOL-2-YLIDENE)-1,3-DIHYDRO-
Systematic Name English
E-804
Code English
Code System Code Type Description
FDA UNII
BYW31FWC1X
Created by admin on Sat Jun 26 04:05:50 UTC 2021 , Edited by admin on Sat Jun 26 04:05:50 UTC 2021
PRIMARY
CAS
1110670-54-6
Created by admin on Sat Jun 26 04:05:50 UTC 2021 , Edited by admin on Sat Jun 26 04:05:50 UTC 2021
ALTERNATIVE
CAS
854171-35-0
Created by admin on Sat Jun 26 04:05:50 UTC 2021 , Edited by admin on Sat Jun 26 04:05:50 UTC 2021
PRIMARY
PUBCHEM
6419764
Created by admin on Sat Jun 26 04:05:50 UTC 2021 , Edited by admin on Sat Jun 26 04:05:50 UTC 2021
PRIMARY