IO-125

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C33H53NO5.C6H14N2.Pt
Molecular Weight	853.05
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Pt++].N[C@@H]1CCCC[C@H]1N.CC(C)CCC[C@@H](C)[C@H]2CC[C@H]3[C@@H]4CC=C5C[C@H](CC[C@]5(C)[C@H]4CC[C@]23C)OCCN(CC([O-])=O)CC([O-])=O

InChI

InChIKey=PJVKGFHWRSKEAS-BQHDTCDWSA-L

InChI=1S/C33H55NO5.C6H14N2.Pt/c1-22(2)7-6-8-23(3)27-11-12-28-26-10-9-24-19-25(39-18-17-34(20-30(35)36)21-31(37)38)13-15-32(24,4)29(26)14-16-33(27,28)5;7-5-3-1-2-4-6(5)8;/h9,22-23,25-29H,6-8,10-21H2,1-5H3,(H,35,36)(H,37,38);5-6H,1-4,7-8H2;/q;;+2/p-2/t23-,25+,26+,27-,28+,29+,32+,33-;5-,6-;/m11./s1

HIDE SMILES / InChI

Molecular Formula	C6H14N2
Molecular Weight	114.1888
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	Pt
Molecular Weight	195.084
Charge	2
Count

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

Molecular Formula	C33H53NO5
Molecular Weight	543.7776
Charge	-2
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 03:01:41 GMT 2025` Edited by `admin` on `Wed Apr 02 03:01:41 GMT 2025`
Record UNII	33ADJ3MKH2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PLATINUM, (N-((CARBOXY-.KAPPA.O)METHYL)-N-(2-((3.BETA.)-CHOLEST-5-EN-3-YLOXY)ETHYL)GLYCINATO(2-)-.KAPPA.N)((1R,2R)-1,2-CYCLOHEXANEDIAMINE-.KAPPA.N1,.KAPPA.N2)-, (SP-4-3)-

Preferred Name

English

IO-125

Code

English

Code System Code Type Description

FDA UNII

33ADJ3MKH2

Created by admin on Wed Apr 02 03:01:41 GMT 2025 , Edited by admin on Wed Apr 02 03:01:41 GMT 2025

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PUBCHEM

91971273

Created by admin on Wed Apr 02 03:01:41 GMT 2025 , Edited by admin on Wed Apr 02 03:01:41 GMT 2025

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CAS

1640353-78-1

Created by admin on Wed Apr 02 03:01:41 GMT 2025 , Edited by admin on Wed Apr 02 03:01:41 GMT 2025

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