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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H25N3O3
Molecular Weight 415.4843
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACETYLASZONALENIN

SMILES

[H][C@]12C[C@@]3(C4=CC=CC=C4N(C(C)=O)[C@]3([H])N1C(=O)C5=CC=CC=C5NC2=O)C(C)(C)C=C

InChI

InChIKey=TXNJQKDZOVFCAQ-XRODADMRSA-N
InChI=1S/C25H25N3O3/c1-5-24(3,4)25-14-20-21(30)26-18-12-8-6-10-16(18)22(31)28(20)23(25)27(15(2)29)19-13-9-7-11-17(19)25/h5-13,20,23H,1,14H2,2-4H3,(H,26,30)/t20-,23-,25+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ACETYLASZONALENIN
Common Name English
LL-S490.BETA.
Code English
(5AS,13AR,14AS)-5-ACETYL-14A-(1,1-DIMETHYL-2-PROPEN-1-YL)-5A,13A,14,14A-TETRAHYDROINDOLO(3',2':4,5)PYRROLO(2,1-C)(1,4)BENZODIAZEPINE-7,13(5H,12H)-DIONE
Systematic Name English
LL-S-490.BETA.
Code English
LL-S 490B
Code English
INDOLO(3',2':4,5)PYRROLO(2,1-C)(1,4)BENZODIAZEPINE-7,13(5H,12H)-DIONE, 5-ACETYL-14A-(1,1-DIMETHYL-2-PROPEN-1-YL)-5A,13A,14,14A-TETRAHYDRO-, (5AS,13AR,14AS)-
Systematic Name English
ACETYLASZONALENIN, (+)-
Common Name English
Code System Code Type Description
MANUFACTURER PRODUCT INFORMATION
LL-S490.BETA.
Created by admin on Sat Dec 16 19:10:00 GMT 2023 , Edited by admin on Sat Dec 16 19:10:00 GMT 2023
PRIMARY J. Org. Chem., 1973, 38(24), pp 4204-4205, DOI: 10.1021/jo00963a024
CAS
42230-55-7
Created by admin on Sat Dec 16 19:10:00 GMT 2023 , Edited by admin on Sat Dec 16 19:10:00 GMT 2023
PRIMARY
PUBCHEM
102032591
Created by admin on Sat Dec 16 19:10:00 GMT 2023 , Edited by admin on Sat Dec 16 19:10:00 GMT 2023
PRIMARY
FDA UNII
7R0Z5D1T6F
Created by admin on Sat Dec 16 19:10:00 GMT 2023 , Edited by admin on Sat Dec 16 19:10:00 GMT 2023
PRIMARY