7-Methyl-5?-guanylic acid inner salt

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C11H16N5O8P
Molecular Weight	377.2472
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7-Methyl-5?-guanylic acid inner salt

Structure Search

SMILES

C[N+]1=CN([C@@H]2O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]2O)C3=C1C(=O)N=C(N)N3

InChI

InChIKey=AOKQNZVJJXPUQA-KQYNXXCUSA-N

InChI=1S/C11H16N5O8P/c1-15-3-16(8-5(15)9(19)14-11(12)13-8)10-7(18)6(17)4(24-10)2-23-25(20,21)22/h3-4,6-7,10,17-18H,2H2,1H3,(H4-,12,13,14,19,20,21,22)/t4-,6-,7-,10-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C11H16N5O8P
Molecular Weight	377.2472
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 `Wed Apr 02 17:05:49 GMT 2025` Edited by `admin` on `Wed Apr 02 17:05:49 GMT 2025`
Record UNII	EKR5MM3F8S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

7-Methyl-5?-guanylic acid inner salt

Common Name

English

1H-Purinium, 2-amino-6,9-dihydro-7-methyl-6-oxo-9-(5-O-phosphono-?-D-ribofuranosyl)-, inner salt

Preferred Name

English

5?-Guanylic acid, 7-methyl-, inner salt

Common Name

English

Purinium, 2-amino-1,6-dihydro-7-methyl-6-oxo-9-?-D-ribofuranosyl-, hydroxide, 5?-(dihydrogen phosphate), inner salt

Common Name

English

2-Amino-1,6-dihydro-7-methyl-6-oxo-9-?-D-ribofuranosylpurinium hydroxide, 5?-phosphate, inner salt

Common Name

English

Code System Code Type Description

FDA UNII

EKR5MM3F8S

Created by admin on Wed Apr 02 17:05:50 GMT 2025 , Edited by admin on Wed Apr 02 17:05:50 GMT 2025

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CAS

10162-58-0

Created by admin on Wed Apr 02 17:05:50 GMT 2025 , Edited by admin on Wed Apr 02 17:05:50 GMT 2025

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PUBCHEM

11810931

Created by admin on Wed Apr 02 17:05:50 GMT 2025 , Edited by admin on Wed Apr 02 17:05:50 GMT 2025

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EPA CompTox

DTXSID80906399

Created by admin on Wed Apr 02 17:05:50 GMT 2025 , Edited by admin on Wed Apr 02 17:05:50 GMT 2025

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