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Details

Stereochemistry ACHIRAL
Molecular Formula C32H30N2O4
Molecular Weight 506.5916
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ASTERRIQUINONE

SMILES

CC(C)(C=C)N1C=C(C2=C1C=CC=C2)C3=C(O)C(=O)C(C4=CN(C5=C4C=CC=C5)C(C)(C)C=C)=C(O)C3=O

InChI

InChIKey=KMHWTYMNRHJTQG-UHFFFAOYSA-N
InChI=1S/C32H30N2O4/c1-7-31(3,4)33-17-21(19-13-9-11-15-23(19)33)25-27(35)29(37)26(30(38)28(25)36)22-18-34(32(5,6)8-2)24-16-12-10-14-20(22)24/h7-18,35,38H,1-2H2,3-6H3

HIDE SMILES / InChI

Molecular Formula C32H30N2O4
Molecular Weight 506.5916
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 Mon Mar 31 19:06:28 GMT 2025
Edited
by admin
on Mon Mar 31 19:06:28 GMT 2025
Record UNII
JV64RB1EJO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ASTERRIQUINONE
Common Name English
NSC-289487
Preferred Name English
2,5-CYCLOHEXADIENE-1,4-DIONE, 2,5-BIS(1-(1,1-DIMETHYL-2-PROPENYL)-1H-INDOL-3-YL)-3,6-DIHYDROXY-
Systematic Name English
2,5-CYCLOHEXADIENE-1,4-DIONE, 2,5-BIS(1-(1,1-DIMETHYL-2-PROPEN-1-YL)-1H-INDOL-3-YL)-3,6-DIHYDROXY-
Systematic Name English
DEMETHYLASTERRIQUINONE A1
Common Name English
2,5-BIS(1-(1,1-DIMETHYL-2-PROPEN-1-YL)-1H-INDOL-3-YL)-3,6-DIHYDROXY-2,5-CYCLOHEXADIENE-1,4-DIONE
Systematic Name English
Code System Code Type Description
FDA UNII
JV64RB1EJO
Created by admin on Mon Mar 31 19:06:28 GMT 2025 , Edited by admin on Mon Mar 31 19:06:28 GMT 2025
PRIMARY
PUBCHEM
100329
Created by admin on Mon Mar 31 19:06:28 GMT 2025 , Edited by admin on Mon Mar 31 19:06:28 GMT 2025
PRIMARY
EPA CompTox
DTXSID90209505
Created by admin on Mon Mar 31 19:06:28 GMT 2025 , Edited by admin on Mon Mar 31 19:06:28 GMT 2025
PRIMARY
NSC
289487
Created by admin on Mon Mar 31 19:06:28 GMT 2025 , Edited by admin on Mon Mar 31 19:06:28 GMT 2025
PRIMARY
CAS
60696-52-8
Created by admin on Mon Mar 31 19:06:28 GMT 2025 , Edited by admin on Mon Mar 31 19:06:28 GMT 2025
PRIMARY