Dibenzocyclooctyne-PEG4 maleimide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C36H42N4O9
Molecular Weight	674.7401
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Dibenzocyclooctyne-PEG4 maleimide

Structure Search

SMILES

O=C(CCOCCOCCOCCOCCNC(=O)CCN1C(=O)C=CC1=O)NCCC(=O)N2CC3=CC=CC=C3C#CC4=CC=CC=C24

InChI

InChIKey=VVFZXPZWVJMYPX-UHFFFAOYSA-N

InChI=1S/C36H42N4O9/c41-32(14-18-39-34(43)11-12-35(39)44)38-17-20-47-22-24-49-26-25-48-23-21-46-19-15-33(42)37-16-13-36(45)40-27-30-7-2-1-5-28(30)9-10-29-6-3-4-8-31(29)40/h1-8,11-12H,13-27H2,(H,37,42)(H,38,41)

HIDE SMILES / InChI

Molecular Formula	C36H42N4O9
Molecular Weight	674.7401
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 `Wed Apr 02 17:22:01 GMT 2025` Edited by `admin` on `Wed Apr 02 17:22:01 GMT 2025`
Record UNII	KJ75Y72NPY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DBCO-PEG4-maleimide

Preferred Name

English

Dibenzocyclooctyne-PEG4 maleimide

Common Name

English

1H-Pyrrole-1-propanamide, N-[19-(11,12-didehydrodibenz[b,f]azocin-5(6H)-yl)-15,19-dioxo-3,6,9,12-tetraoxa-16-azanonadec-1-yl]-2,5-dihydro-2,5-dioxo-

Systematic Name

English

N-[19-(11,12-Didehydrodibenz[b,f]azocin-5(6H)-yl)-15,19-dioxo-3,6,9,12-tetraoxa-16-azanonadec-1-yl]-2,5-dihydro-2,5-dioxo-1H-pyrrole-1-propanamide

Systematic Name

English

Code System Code Type Description

FDA UNII

KJ75Y72NPY

Created by admin on Wed Apr 02 17:22:01 GMT 2025 , Edited by admin on Wed Apr 02 17:22:01 GMT 2025

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CAS

1480516-75-3

Created by admin on Wed Apr 02 17:22:01 GMT 2025 , Edited by admin on Wed Apr 02 17:22:01 GMT 2025

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PUBCHEM

86580488

Created by admin on Wed Apr 02 17:22:01 GMT 2025 , Edited by admin on Wed Apr 02 17:22:01 GMT 2025

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