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Details

Stereochemistry ABSOLUTE
Molecular Formula C42H37N5O6
Molecular Weight 707.7731
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FGN-849

SMILES

[H][C@@]12CC3=CC=CC=C3N1C(=O)C4=C(NC2)C=C(OCC5=CC(N)=CC(COC6=CC7=C(C=C6OC)C(=O)N8C9=CC=CC=C9C[C@@]8([H])C=N7)=C5)C(OC)=C4

InChI

InChIKey=MPZZBNVMDYKZRF-KYJUHHDHSA-N
InChI=1S/C42H37N5O6/c1-50-37-16-31-33(44-20-29-14-26-7-3-5-9-35(26)46(29)41(31)48)18-39(37)52-22-24-11-25(13-28(43)12-24)23-53-40-19-34-32(17-38(40)51-2)42(49)47-30(21-45-34)15-27-8-4-6-10-36(27)47/h3-13,16-20,29-30,45H,14-15,21-23,43H2,1-2H3/t29-,30-/m0/s1

HIDE SMILES / InChI

Molecular Formula C42H37N5O6
Molecular Weight 707.7731
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:43:59 UTC 2023
Edited
by admin
on Sat Dec 16 14:43:59 UTC 2023
Record UNII
RFZ57U5FJE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FGN-849
Code English
FGN849
Code English
IGN 1B
Common Name English
6H-INDOLO(2,1-C)(1,4)BENZODIAZEPIN-6-ONE, 9-((3-AMINO-5-((((12AS)-12A,13-DIHYDRO-8-METHOXY-6-OXO-6H-INDOLO(2,1-C)(1,4)BENZODIAZEPIN-9-YL)OXY)METHYL)PHENYL)METHOXY)-11,12,12A,13-TETRAHYDRO-8-METHOXY-, (12AS)-
Systematic Name English
Code System Code Type Description
CAS
2069250-01-5
Created by admin on Sat Dec 16 14:43:59 UTC 2023 , Edited by admin on Sat Dec 16 14:43:59 UTC 2023
PRIMARY
FDA UNII
RFZ57U5FJE
Created by admin on Sat Dec 16 14:43:59 UTC 2023 , Edited by admin on Sat Dec 16 14:43:59 UTC 2023
PRIMARY
PUBCHEM
91754530
Created by admin on Sat Dec 16 14:43:59 UTC 2023 , Edited by admin on Sat Dec 16 14:43:59 UTC 2023
PRIMARY
Related Record Type Details
PRODRUG -> METABOLITE ACTIVE