PF-04217903 MONOPHOSPHATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H16N8O.H3O4P
Molecular Weight	470.3785
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OP(O)(O)=O.OCCN1C=C(C=N1)C2=CN=C3N=NN(CC4=CC=C5N=CC=CC5=C4)C3=N2

InChI

InChIKey=TWWONGIWZWOGQN-UHFFFAOYSA-N

InChI=1S/C19H16N8O.H3O4P/c28-7-6-26-12-15(9-22-26)17-10-21-18-19(23-17)27(25-24-18)11-13-3-4-16-14(8-13)2-1-5-20-16;1-5(2,3)4/h1-5,8-10,12,28H,6-7,11H2;(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	C19H16N8O
Molecular Weight	372.3833
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 01:48:36 UTC 2023` Edited by `admin` on `Sat Dec 16 01:48:36 UTC 2023`
Record UNII	E1E1K0PK8V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PF-04217903 MONOPHOSPHATE

Common Name

English

1H-PYRAZOLE-1-ETHANOL, 4-(1-(6-QUINOLINYLMETHYL)-1H-1,2,3-TRIAZOLO(4,5-B)PYRAZIN-6-YL)-, PHOSPHATE (1:1)

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C1967