FK-973

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H21N3O9
Molecular Weight	447.3954
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)OC1=C2[C@H](COC(N)=O)[C@]3(OC(C)=O)O[N@](C[C@H]4[C@@H]3N4C(C)=O)C2=CC(C=O)=C1

InChI

InChIKey=FBXPCVIKIBWXAE-ZJZHAWLTSA-N

InChI=1S/C20H21N3O9/c1-9(25)23-15-6-22-14-4-12(7-24)5-16(30-10(2)26)17(14)13(8-29-19(21)28)20(32-22,18(15)23)31-11(3)27/h4-5,7,13,15,18H,6,8H2,1-3H3,(H2,21,28)/t13-,15-,18-,20-,23?/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H21N3O9
Molecular Weight	447.3954
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 `Fri Dec 15 15:28:49 UTC 2023` Edited by `admin` on `Fri Dec 15 15:28:49 UTC 2023`
Record UNII	0X1IR6U63G
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

FK-973

Code

English

3,9-EPOXY-3H-AZIRINO(2,3-C)(1)BENZAZOCINE-5-CARBOXALDEHYDE, 1-ACETYL-7,9-BIS(ACETYLOXY)-8-(((AMINOCARBONYL)OXY)METHYL)-1,1A,2,8,9,9A-HEXAHYDRO-, (1AS,3S,8R,9S,9AS)-

Systematic Name

English

8-(((AMINOCARBONYL)OXY)METHYL)-1,1A,2,8,9,9A-HEXAHYDRO-3,9-EPOXY-3H-AZIRINO(2,3-C)(1)BENZAZOCINE-5-CARBOXALDEHYDE

Systematic Name

English

Code System Code Type Description

CAS

114580-45-9

Created by admin on Fri Dec 15 15:28:49 UTC 2023 , Edited by admin on Fri Dec 15 15:28:49 UTC 2023

PRIMARY

FDA UNII

0X1IR6U63G

Created by admin on Fri Dec 15 15:28:49 UTC 2023 , Edited by admin on Fri Dec 15 15:28:49 UTC 2023

PRIMARY

EPA CompTox

DTXSID00109963

Created by admin on Fri Dec 15 15:28:49 UTC 2023 , Edited by admin on Fri Dec 15 15:28:49 UTC 2023

PRIMARY

PUBCHEM

3035047

Created by admin on Fri Dec 15 15:28:49 UTC 2023 , Edited by admin on Fri Dec 15 15:28:49 UTC 2023

PRIMARY