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Phacolysine

CAT: 0931-T20065-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T20065-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3863-80-7
Target
Others
Related Pathways
Others
Bioactivity
Phacolysine is a chemical compound. Phacolysine is used in ophthalmologic eye lotions.
Smiles
O=S(O)(C1=CC=C2NC3=CC4=NC5=CC(S(=O)(O)=O)=CC=C5NC4=CC3=NC2=C1)=O.[Na].[Na]
Molecular Formula
C18H10N4Na2O6S2
Molecular Weight
488.39
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Disodium 5,14-dihydroquinoxalino(2,3-b)phenazine-2,9-disulfonate
CAS Number3863-80-7
PubChem CID165166
IUPAC Namedisodium;7,12-dihydroquinoxalino[3,2-b]phenazine-2,9-disulfonate
Molecular FormulaC18H10N4Na2O6S2
Molecular Weight488.4
Topological Polar Surface Area181
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count0
Heavy Atom Count32
Formal Charge0
Complexity845
SMILES
C1=CC2=C(C=C1S(=O)(=O)[O-])NC3=C(N2)C=C4C(=C3)N=C5C=CC(=CC5=N4)S(=O)(=O)[O-].[Na+].[Na+]
InChI
InChI=1S/C18H12N4O6S2.2Na/c23-29(24,25)9-1-3-11-13(5-9)21-17-8-16-18(7-15(17)19-11)22-14-6-10(30(26,27)28)2-4-12(14)20-16;;/h1-8,19,21H,(H,23,24,25)(H,26,27,28);;/q;2*+1/p-2
InChIKey
SZGZILRQIYNODJ-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Disodium 5,14-dihydroquinoxalino(2,3-b)phenazine-2,9-disulfonate
CAS: 3863-80-7
CID: 165166
Formula: C18H10N4Na2O6S2
MW: 488.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight488.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count0
Exact Mass487.98371496
Monoisotopic Mass487.98371496
Topological Polar Surface Area181 Ų
Heavy Atom Count32
Formal Charge0
Complexity845
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

Alternative Products

CatalogName
596224Phacolysine
sc-212541Phacolysine Sodium Salt
286754Phacolysine Sodium Salt discontinued

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