NPC-15669 SODIUM

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H26NO4.Na
Molecular Weight	403.4466
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].CC(C)C[C@H](NC(=O)OCC1C2=CC(C)=CC=C2C3=C1C=C(C)C=C3)C([O-])=O

InChI

InChIKey=AVOJMBGIPJKANP-BOXHHOBZSA-M

InChI=1S/C23H27NO4.Na/c1-13(2)9-21(22(25)26)24-23(27)28-12-20-18-10-14(3)5-7-16(18)17-8-6-15(4)11-19(17)20;/h5-8,10-11,13,20-21H,9,12H2,1-4H3,(H,24,27)(H,25,26);/q;+1/p-1/t21-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C23H26NO4
Molecular Weight	380.4568
Charge	-1
Count

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

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
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 `Fri Dec 15 15:44:11 GMT 2023` Edited by `admin` on `Fri Dec 15 15:44:11 GMT 2023`
Record UNII	5L1JYH5OJ1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NPC-15669 SODIUM

Code

English

Code System Code Type Description

FDA UNII

5L1JYH5OJ1

Created by admin on Fri Dec 15 15:44:12 GMT 2023 , Edited by admin on Fri Dec 15 15:44:12 GMT 2023

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PUBCHEM

134687082

Created by admin on Fri Dec 15 15:44:12 GMT 2023 , Edited by admin on Fri Dec 15 15:44:12 GMT 2023

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NPC-15669

PARENT -> SALT/SOLVATE