FR-48736

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H23N7O6
Molecular Weight	457.4399
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC=C(C[C@H](N)C(=O)N[C@H]2[C@@H](O)[C@@H](O[C@@H]2C(O)=O)N3C=NC4=C3N=CN=C4N)C=C1

InChI

InChIKey=TXYMIIPGRTXESZ-JDZCFQESSA-N

InChI=1S/C20H23N7O6/c1-32-10-4-2-9(3-5-10)6-11(21)18(29)26-12-14(28)19(33-15(12)20(30)31)27-8-25-13-16(22)23-7-24-17(13)27/h2-5,7-8,11-12,14-15,19,28H,6,21H2,1H3,(H,26,29)(H,30,31)(H2,22,23,24)/t11-,12-,14+,15-,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H23N7O6
Molecular Weight	457.4399
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:09:03 GMT 2025` Edited by `admin` on `Wed Apr 02 17:09:03 GMT 2025`
Record UNII	W9BY579JEW
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

FR-48736

Code

English

Chryscandin

Preferred Name

English

?-D-Ribofuranuronic acid, 3-[[2-amino-3-(4-methoxyphenyl)-1-oxopropyl]amino]-1-(6-amino-9H-purin-9-yl)-1,3-dideoxy-, (S)-

Systematic Name

English

3-[[(2S)-2-Amino-3-(4-methoxyphenyl)-1-oxopropyl]amino]-1-(6-amino-9H-purin-9-yl)-1,3-dideoxy-?-D-ribofuranuronic acid

Systematic Name

English

?-D-Ribofuranuronic acid, 3-[[(2S)-2-amino-3-(4-methoxyphenyl)-1-oxopropyl]amino]-1-(6-amino-9H-purin-9-yl)-1,3-dideoxy-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID901007193

Created by admin on Wed Apr 02 17:09:03 GMT 2025 , Edited by admin on Wed Apr 02 17:09:03 GMT 2025

PRIMARY

FDA UNII

W9BY579JEW

Created by admin on Wed Apr 02 17:09:03 GMT 2025 , Edited by admin on Wed Apr 02 17:09:03 GMT 2025

PRIMARY

PUBCHEM

72477

Created by admin on Wed Apr 02 17:09:03 GMT 2025 , Edited by admin on Wed Apr 02 17:09:03 GMT 2025

PRIMARY

CAS

86936-90-5

Created by admin on Wed Apr 02 17:09:03 GMT 2025 , Edited by admin on Wed Apr 02 17:09:03 GMT 2025

PRIMARY

Related Record Type Details


					CXX68L7PGH

FR-48736 dihydrochloride

SALT/SOLVATE -> PARENT

Amount: