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Cypridina luciferin

CAT: 0013-GTR19223654-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19223654-01Size:25 mg
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Description
Cypridina luciferin is a natural substrate for Vargula luciferase, enabling highly sensitive bioluminescent assays. It is widely used in molecular and cellular biology for in vitro reporter gene studies and in vivo imaging applications to monitor biological processes.
CAS Number
876351-00-7
Smiles
C (CCNC (=N) N) C1=C2N (C=C (N1) C=3C=4C (NC3) =CC=CC4) C (=O) C ([C@H] (CC) C) =N2
Molecular Formula
C22H27N7O
Molecular Weight
405.50
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Cypridina luciferin

Cypridina luciferin is a member of guanidines, a member of indoles and an imidazopyrazine. It has a role as a luciferin. It is a conjugate base of a Cypridina luciferin(1+). It derives from a hydride of an imidazo[1,2-a]pyrazine.

CAS Number876351-00-7
PubChem CID135398684
IUPAC Name2-[3-[2-[(2S)-butan-2-yl]-3-hydroxy-6-(1H-indol-3-yl)imidazo[1,2-a]pyrazin-8-yl]propyl]guanidine
Molecular FormulaC22H27N7O
Molecular Weight405.5
XLogP3.1
Topological Polar Surface Area131
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count30
Formal Charge0
Complexity598
SMILES
CC[C@H](C)C1=C(N2C=C(N=C(C2=N1)CCCN=C(N)N)C3=CNC4=CC=CC=C43)O
InChI
InChI=1S/C22H27N7O/c1-3-13(2)19-21(30)29-12-18(15-11-26-16-8-5-4-7-14(15)16)27-17(20(29)28-19)9-6-10-25-22(23)24/h4-5,7-8,11-13,26,30H,3,6,9-10H2,1-2H3,(H4,23,24,25)/t13-/m0/s1
InChIKey
AVNJFDTZJJNPKF-ZDUSSCGKSA-N
Chemical Structure
2D Structure
2D structure of Cypridina luciferin
CAS: 876351-00-7
CID: 135398684
Formula: C22H27N7O
MW: 405.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight405.5
XLogP33.1
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass405.22770851
Monoisotopic Mass405.22770851
Topological Polar Surface Area131 Ų
Heavy Atom Count30
Formal Charge0
Complexity598
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes