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Endophenazine D

CAT: 0931-TN10899-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-TN10899-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
479415-44-6
Target
Antibacterial, Antibiotic
Related Pathways
Microbiology/Virology
Bioactivity
Endophenazine D is a phenazine-class antibiotic.
Smiles
O=C(OCC(=O)O)C=1C=CC=C2NC=3C=CC=CC3NC21
Molecular Formula
C15H12N2O4
Molecular Weight
284.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Endophenazine D

Endophenazine D is an O-acyl carbohydrate.

CAS Number479415-44-6
PubChem CID139583847
IUPAC Name9-[3-methyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxybut-1-enyl]phenazine-1-carboxylic acid
Molecular FormulaC24H26N2O7
Molecular Weight454.5
XLogP1.4
Topological Polar Surface Area142
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Heavy Atom Count33
Formal Charge0
Complexity732
SMILES
C[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)OC(C)(C)C=CC2=C3C(=CC=C2)N=C4C=CC=C(C4=N3)C(=O)O)O)O)O
InChI
InChI=1S/C24H26N2O7/c1-12-19(27)20(28)21(29)23(32-12)33-24(2,3)11-10-13-6-4-8-15-17(13)26-18-14(22(30)31)7-5-9-16(18)25-15/h4-12,19-21,23,27-29H,1-3H3,(H,30,31)/t12-,19-,20+,21+,23+/m0/s1
InChIKey
RSOXYAUKSAEFIK-VCBFIBSESA-N
Chemical Structure
2D Structure
2D structure of Endophenazine D
CAS: 479415-44-6
CID: 139583847
Formula: C24H26N2O7
MW: 454.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight454.5
XLogP31.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Exact Mass454.17400117
Monoisotopic Mass454.17400117
Topological Polar Surface Area142 Ų
Heavy Atom Count33
Formal Charge0
Complexity732
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
TRC-E555480-25MGEndophenazine A
HY-N14846Endophenazine C
TRC-E555485-1MGEndophenazine B
HY-N14848Endophenazine D

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