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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H23N3O3
Molecular Weight 365.4256
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BREVIANAMIDE B

SMILES

[H][C@@]12C[C@@]34CCCN3C(=O)[C@]1(C[C@]5(NC6=CC=CC=C6C5=O)C2(C)C)NC4=O

InChI

InChIKey=MWOFPQAPILIIPR-RKTMXUFFSA-N
InChI=1S/C21H23N3O3/c1-18(2)14-10-19-8-5-9-24(19)17(27)20(14,23-16(19)26)11-21(18)15(25)12-6-3-4-7-13(12)22-21/h3-4,6-7,14,22H,5,8-11H2,1-2H3,(H,23,26)/t14-,19+,20+,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H23N3O3
Molecular Weight 365.4256
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:01:48 GMT 2023
Edited
by admin
on Sat Dec 16 12:01:48 GMT 2023
Record UNII
RTJ0M35T4U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BREVIANAMIDE B
Common Name English
(2'S,5AR,8AS,9AR)-2,3,8A,9-TETRAHYDRO-8,8-DIMETHYLSPIRO(5H,6H-5A,9A-(IMINOMETHANO)-1H-CYCLOPENT(F)INDOLIZINE-7(8H),2'-(2H)INDOLE)-3',5,10(1'H)-TRIONE
Systematic Name English
(-)-BREVIANAMIDE B
Common Name English
BREVIANAMIDE B, (-)-
Common Name English
SPIRO(5H,6H-5A,9A-(IMINOMETHANO)-1H-CYCLOPENT(F)INDOLIZINE-7(8H),2'-(2H)INDOLE)-3',5,10(1'H)-TRIONE, 2,3,8A,9-TETRAHYDRO-8,8-DIMETHYL-, (2'S,5AR,8AS,9AR)-
Systematic Name English
SPIRO(5H,6H-5A,9A-(IMINOMETHANO)-1H-CYCLOPENT(F)INDOLIZINE-7(8H),2'-(2H)INDOLE)-3',5,10(1'H)-TRIONE, 2,3,8A,9-TETRAHYDRO-8,8-DIMETHYL-, (5AR-(5A.ALPHA.,7.ALPHA.,8A.BETA.,9A.ALPHA.))-
Systematic Name English
Code System Code Type Description
CAS
38136-92-4
Created by admin on Sat Dec 16 12:01:48 GMT 2023 , Edited by admin on Sat Dec 16 12:01:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID70959076
Created by admin on Sat Dec 16 12:01:48 GMT 2023 , Edited by admin on Sat Dec 16 12:01:48 GMT 2023
PRIMARY
FDA UNII
RTJ0M35T4U
Created by admin on Sat Dec 16 12:01:48 GMT 2023 , Edited by admin on Sat Dec 16 12:01:48 GMT 2023
PRIMARY
PUBCHEM
10937413
Created by admin on Sat Dec 16 12:01:48 GMT 2023 , Edited by admin on Sat Dec 16 12:01:48 GMT 2023
PRIMARY