ASP-8731 PHOSPHATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H21N5O4.H3O4P
Molecular Weight	493.407
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OP(O)(O)=O.CN1C(NC2=NC3=C(O2)C=CC=C3)=NC4=C1C=CC(=C4)C(=O)NCCOCCO

InChI

InChIKey=SXTOFDWIQYUHQF-UHFFFAOYSA-N

InChI=1S/C20H21N5O4.H3O4P/c1-25-16-7-6-13(18(27)21-8-10-28-11-9-26)12-15(16)22-19(25)24-20-23-14-4-2-3-5-17(14)29-20;1-5(2,3)4/h2-7,12,26H,8-11H2,1H3,(H,21,27)(H,22,23,24);(H3,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula	H3O4P
Molecular Weight	97.9952
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C20H21N5O4
Molecular Weight	395.4118
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:53:41 GMT 2023` Edited by `admin` on `Sat Dec 16 18:53:41 GMT 2023`
Record UNII	ZTQ38HN3AA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ASP-8731 PHOSPHATE

Code

English

ASP8731 PHOSPHATE

Code

English

Classification Tree Code System Code

FDA ORPHAN DRUG

897122

Created by admin on Sat Dec 16 18:53:41 GMT 2023 , Edited by admin on Sat Dec 16 18:53:41 GMT 2023

Code System Code Type Description

CAS

2822580-18-5

Created by admin on Sat Dec 16 18:53:41 GMT 2023 , Edited by admin on Sat Dec 16 18:53:41 GMT 2023

PRIMARY

PUBCHEM

168429480

Created by admin on Sat Dec 16 18:53:41 GMT 2023 , Edited by admin on Sat Dec 16 18:53:41 GMT 2023

PRIMARY

FDA UNII

ZTQ38HN3AA

Created by admin on Sat Dec 16 18:53:41 GMT 2023 , Edited by admin on Sat Dec 16 18:53:41 GMT 2023

PRIMARY

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