LYSYL BARZUXETAN YTTRIUM Y-90

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H43N6O12S.Y.2H
Molecular Weight	827.705
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of LYSYL BARZUXETAN YTTRIUM Y-90

Structure Search

SMILES

[H+].[H+].[90Y+3].N[C@@H](CCCCNC(=S)NC1=CC=C(C[C@H](CN(CC([O-])=O)[C@H]2CCCC[C@@H]2N(CC([O-])=O)CC([O-])=O)N(CC([O-])=O)CC([O-])=O)C=C1)C(O)=O

InChI

InChIKey=QYULWCVWTPHZLA-NDQALIDPSA-K

InChI=1S/C32H48N6O12S.Y/c33-23(31(49)50)5-3-4-12-34-32(51)35-21-10-8-20(9-11-21)13-22(36(15-26(39)40)16-27(41)42)14-37(17-28(43)44)24-6-1-2-7-25(24)38(18-29(45)46)19-30(47)48;/h8-11,22-25H,1-7,12-19,33H2,(H,39,40)(H,41,42)(H,43,44)(H,45,46)(H,47,48)(H,49,50)(H2,34,35,51);/q;+3/p-3/t22-,23+,24+,25+;/m1./s1/i;1+1

HIDE SMILES / InChI

Molecular Formula	C32H43N6O12S
Molecular Weight	735.782
Charge	-5
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	H
Molecular Weight	1.0079
Charge	1
Count

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

Molecular Formula	Y
Molecular Weight	89.9072
Charge	3
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 `Sat Dec 16 15:01:04 GMT 2023` Edited by `admin` on `Sat Dec 16 15:01:04 GMT 2023`
Record UNII	4OI7ULC7WB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LYSYL BARZUXETAN YTTRIUM Y-90

Common Name

English

Code System Code Type Description

PUBCHEM

139593413

Created by admin on Sat Dec 16 15:01:04 GMT 2023 , Edited by admin on Sat Dec 16 15:01:04 GMT 2023

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FDA UNII

4OI7ULC7WB

Created by admin on Sat Dec 16 15:01:04 GMT 2023 , Edited by admin on Sat Dec 16 15:01:04 GMT 2023

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