7,8-DIHYDRONEOPTERIN

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C9H13N5O4
Molecular Weight	255.2306
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7,8-DIHYDRONEOPTERIN

Structure Search

SMILES

NC1=NC(=O)C2=C(N1)N=C(CN2)[C@H](O)[C@H](O)CO

InChI

InChIKey=AWXJKYFUMOXWCO-XINAWCOVSA-N

InChI=1S/C9H13N5O4/c10-9-13-7-5(8(18)14-9)11-1-3(12-7)6(17)4(16)2-15/h4,6,11,15-17H,1-2H2,(H3,10,13,14,18)/t4-,6+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C9H13N5O4
Molecular Weight	255.2306
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 `Tue Apr 01 16:43:22 GMT 2025` Edited by `admin` on `Tue Apr 01 16:43:22 GMT 2025`
Record UNII	9U3LTY5WP8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

D-ERYTHRO-7,8-DIHYDRONEOPTERIN

Preferred Name

English

7,8-DIHYDRONEOPTERIN

Common Name

English

4(3H)-PTERIDINONE, 2-AMINO-7,8-DIHYDRO-6-((1S,2R)-1,2,3-TRIHYDROXYPROPYL)-

Systematic Name

English

1,2,3-PROPANETRIOL, 1-(2-AMINO-7,8-DIHYDRO-4-HYDROXY-6-PTERIDINYL)-, D-ERYTHRO-

Systematic Name

English

2-AMINO-4-HYDROXY-6-(D-ERYTHRO-1,2,3-TRIHYDROXYPROPYL)-7,8-DIHYDROPTERIDINE

Systematic Name

English

Code System Code Type Description

CHEBI

17001

Created by admin on Tue Apr 01 16:43:22 GMT 2025 , Edited by admin on Tue Apr 01 16:43:22 GMT 2025

PRIMARY

EPA CompTox

DTXSID00153368

Created by admin on Tue Apr 01 16:43:22 GMT 2025 , Edited by admin on Tue Apr 01 16:43:22 GMT 2025

PRIMARY

CAS

1218-98-0

Created by admin on Tue Apr 01 16:43:22 GMT 2025 , Edited by admin on Tue Apr 01 16:43:22 GMT 2025

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FDA UNII

9U3LTY5WP8

Created by admin on Tue Apr 01 16:43:22 GMT 2025 , Edited by admin on Tue Apr 01 16:43:22 GMT 2025

PRIMARY

DRUG BANK

DB04425

Created by admin on Tue Apr 01 16:43:22 GMT 2025 , Edited by admin on Tue Apr 01 16:43:22 GMT 2025

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PUBCHEM

162623833

Created by admin on Tue Apr 01 16:43:22 GMT 2025 , Edited by admin on Tue Apr 01 16:43:22 GMT 2025

PRIMARY

Related Record Type Details


					2QZF69EBZ9

2-AMINO-7,8-DIHYDRO-6-((1R,2S)-1,2,3-TRIHYDROXYPROPYL)-4(3H)-PTERIDINONE, REL-

RACEMATE -> ENANTIOMER

Amount: