PENTETATE CALCIUM TRISODIUM YB-169

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H18N3O10.Ca.3Na.Yb
Molecular Weight	666.289
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PENTETATE CALCIUM TRISODIUM YB-169

Structure Search

SMILES

[Na+].[Na+].[Na+].[Ca++].[169Yb].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CCN(CC([O-])=O)CC([O-])=O

InChI

InChIKey=YXZBWJWYWHRIMU-UBPCSPHJSA-I

InChI=1S/C14H23N3O10.Ca.3Na.Yb/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27;;;;;/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27);;;;;/q;+2;3*+1;/p-5/i;;;;;1-4

HIDE SMILES / InChI

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

Molecular Formula	C14H18N3O10
Molecular Weight	388.3068
Charge	-5
Count

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

Molecular Formula	Ca
Molecular Weight	40.078
Charge	2
Count

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

Molecular Formula	Yb
Molecular Weight	168.9352
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 `Fri Dec 15 15:09:25 UTC 2023` Edited by `admin` on `Fri Dec 15 15:09:25 UTC 2023`
Record UNII	Q6RE2BCW3P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PENTETATE CALCIUM TRISODIUM YB-169

Official Name

English

PENTETATE CALCIUM TRISODIUM YB 169 [USAN]

Common Name

English

COMPOUND 24266

Code

English

PENTETATE CALCIUM TRISODIUM YB-169 [ORANGE BOOK]

Common Name

English

YTTERBIUM YB-169 PENTETATE TRISODIUM CALCIUM

Common Name

English

COMPOUND-24266

Code

English

MATERIAL-A

Code

English

YTTERBIUM YB-169 DTPA

Common Name

English

CALCIATE(3-), (N,N-BIS(2-(BIS(CARBOXYMETHYL)AMINO)ETHYL)GLYCINATO(5-))-, TRISODIUM, LABELED WITH YTTERBIUM-169

Common Name

English

Trisodium [N,N-bis[2-[bis(carboxymethyl)amino]ethyl]glycinato(5-)]calciate(3-), labeled with ytterbium-169

Common Name

English

MRP-10

Code

English

MATERIAL A

Code

English

Code System Code Type Description

NCI_THESAURUS

C174872