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Endophenazine B

CAT: 0931-TN10368-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-TN10368-02Size:50 mg
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CAS Number
479415-40-2
Target
Antibacterial, Antibiotic
Related Pathways
Microbiology/Virology
Bioactivity
Endophenazine B is a type of phenazine antibiotic that exhibits low herbicidal activity against duckweed.
Smiles
O=C1C=C2C(=NC3=C(C=CC=C3N2C)C(=O)O)C(=C1)CC=C(C)C
Molecular Formula
C19H18N2O3
Molecular Weight
322.358
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Endophenazine B

Endophenazine B is a member of phenazines.

CAS Number479415-40-2
PubChem CID9973416
IUPAC Name5-methyl-9-(3-methylbut-2-enyl)-7-oxophenazine-1-carboxylic acid
Molecular FormulaC19H18N2O3
Molecular Weight322.4
XLogP3.1
Topological Polar Surface Area70
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count24
Formal Charge0
Complexity695
SMILES
CC(=CCC1=CC(=O)C=C2C1=NC3=C(C=CC=C3N2C)C(=O)O)C
InChI
InChI=1S/C19H18N2O3/c1-11(2)7-8-12-9-13(22)10-16-17(12)20-18-14(19(23)24)5-4-6-15(18)21(16)3/h4-7,9-10H,8H2,1-3H3,(H,23,24)
InChIKey
CIWWONHFDUMHHK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Endophenazine B
CAS: 479415-40-2
CID: 9973416
Formula: C19H18N2O3
MW: 322.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight322.4
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass322.13174244
Monoisotopic Mass322.13174244
Topological Polar Surface Area70 Ų
Heavy Atom Count24
Formal Charge0
Complexity695
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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Alternative Products

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TRC-E555485-1MGEndophenazine B
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