BMS-180431-09, L-ARGININE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H22F2N4O4.C6H14N4O2
Molecular Weight	630.6429
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

N[C@@H](CCCNC(N)=N)C(O)=O.CN1N=NN=C1C(\C=C\[C@@H](O)C[C@@H](O)CC(O)=O)=C(C2=CC=C(F)C=C2)C3=CC=C(F)C=C3

InChI

InChIKey=PESQKIWGJSPDOS-WZFBWHNSSA-N

InChI=1S/C23H22F2N4O4.C6H14N4O2/c1-29-23(26-27-28-29)20(11-10-18(30)12-19(31)13-21(32)33)22(14-2-6-16(24)7-3-14)15-4-8-17(25)9-5-15;7-4(5(11)12)2-1-3-10-6(8)9/h2-11,18-19,30-31H,12-13H2,1H3,(H,32,33);4H,1-3,7H2,(H,11,12)(H4,8,9,10)/b11-10+;/t18-,19-;4-/m10/s1

HIDE SMILES / InChI

Molecular Formula	C23H22F2N4O4
Molecular Weight	456.442
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	1
Optical Activity	UNSPECIFIED

Molecular Formula	C6H14N4O2
Molecular Weight	174.201
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 05:44:13 UTC 2023` Edited by `admin` on `Sat Dec 16 05:44:13 UTC 2023`
Record UNII	A6LU207NC3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BMS-180431-09, L-ARGININE

Code

English

9,9-BIS(4-FLUOROPHENYL)-3,5-DIHYDROXY-8-(1-METHYL-1H-TETRAZOL-5-YL)-6,8-NONADIENOIC ACID(3R,5S,6E) ARGININE SALT

Common Name

English

L-ARGININE, MONO((S-(R*,S*-(E)))-9,9-BIS(4-FLUOROPHENYL)-3,5-DIHYDROXY-8-(1-METHYL-1H-TETRAZOL-5-YL)-6,8-NONADIENOATE)

Systematic Name

English

6,8-NONADIENOIC ACID, 9,9-BIS(4-FLUOROPHENYL)-3,5-DIHYDROXY-8-(1-METHYL-1H-TETRAZOL-5-YL)-, (S-(R*,S*-(E)))-, COMPD. WITH L-ARGININE (1:1)

Common Name

English

Code System Code Type Description

PUBCHEM

138455048

Created by admin on Sat Dec 16 05:44:13 UTC 2023 , Edited by admin on Sat Dec 16 05:44:13 UTC 2023

PRIMARY

CAS

169758-59-2

Created by admin on Sat Dec 16 05:44:13 UTC 2023 , Edited by admin on Sat Dec 16 05:44:13 UTC 2023

PRIMARY

FDA UNII

A6LU207NC3

Created by admin on Sat Dec 16 05:44:13 UTC 2023 , Edited by admin on Sat Dec 16 05:44:13 UTC 2023

PRIMARY

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