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Coelenterazine h

CAT: 0572-TRC-C636025-5MGSize: 5 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-C636025-5MGSize:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
50909-86-9
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
Oc1ccc(cc1)C2=CN3C(=O)C(=NC3=C(Cc4ccccc4)N2)Cc5ccccc5
Molecular Formula
C26 H21 N3 O2
Molecular Weight
407.464
InChI
InChI=1S/C26H21N3O2/c30-21-13-11-20(12-14-21)24-17-29-25(22(27-24)15-18-7-3-1-4-8-18)28-23(26(29)31)16-19-9-5-2-6-10-19/h1-14,17,27,30H,15-16H2
Additionnal Information
IUPAC name: 2,8-dibenzyl-6-(4-hydroxyphenyl)-7H-imidazo[1,2-a]pyrazin-3-one
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Coelenterazine H

Renilla luciferin is a member of phenols and an imidazopyrazine. It has a role as a luciferin. It derives from a hydride of an imidazo[1,2-a]pyrazine.

CAS Number50909-86-9
PubChem CID135398664
IUPAC Name2,8-dibenzyl-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3-ol
Molecular FormulaC26H21N3O2
Molecular Weight407.5
XLogP5.9
Topological Polar Surface Area70.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count31
Formal Charge0
Complexity555
SMILES
C1=CC=C(C=C1)CC2=C(N3C=C(N=C(C3=N2)CC4=CC=CC=C4)C5=CC=C(C=C5)O)O
InChI
InChI=1S/C26H21N3O2/c30-21-13-11-20(12-14-21)24-17-29-25(22(27-24)15-18-7-3-1-4-8-18)28-23(26(29)31)16-19-9-5-2-6-10-19/h1-14,17,30-31H,15-16H2
InChIKey
MGTUVUVRFJVHAL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Coelenterazine H
CAS: 50909-86-9
CID: 135398664
Formula: C26H21N3O2
MW: 407.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight407.5
XLogP35.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass407.16337692
Monoisotopic Mass407.16337692
Topological Polar Surface Area70.7 Ų
Heavy Atom Count31
Formal Charge0
Complexity555
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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