Ekatetrone

CAT: 0013-GTR19256218-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19256218-02Size:10 mg

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Description

Ekatetrone displays activity against both Gram-positive and Gram-negative bacteria, with particularly strong inhibitory effects on Mycobacterium tuberculosis.

CAS Number

12794-19-3

Field of Research

Infectious Disease & Virology

Smiles

OC1=C2C (=CC3=C1C (CC (N) =O) OC (=O) C3) C (=O) C=4C (C2=O) =C (O) C=CC4

Molecular Formula

C19H13NO7

Molecular Weight

367.309

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

(+)-3,4,6,11-Tetrahydro-10,12-dihydroxy-3,6,11-trioxo-1H-anthra(2,3-c)pyran-1-acetamide

structure

CAS Number	12794-19-3
PubChem CID	92272322
IUPAC Name	2-[(1S)-10,12-dihydroxy-3,6,11-trioxo-1,4-dihydronaphtho[2,3-g]isochromen-1-yl]acetamide
Molecular Formula	C19H13NO7
Molecular Weight	367.3
XLogP	1
Topological Polar Surface Area	144
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Heavy Atom Count	27
Formal Charge	0
Complexity	692

SMILES

C1C2=CC3=C(C(=C2[C@@H](OC1=O)CC(=O)N)O)C(=O)C4=C(C3=O)C=CC=C4O

InChI

InChI=1S/C19H13NO7/c20-12(22)6-11-14-7(5-13(23)27-11)4-9-16(18(14)25)19(26)15-8(17(9)24)2-1-3-10(15)21/h1-4,11,21,25H,5-6H2,(H2,20,22)/t11-/m0/s1

InChIKey

QZENCFIHIPLZMU-NSHDSACASA-N

Chemical Structure

2D Structure

CAS: 12794-19-3

CID: 92272322

Formula: C19H13NO7

MW: 367.3

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	367.3
XLogP3	1
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Exact Mass	367.06920175
Monoisotopic Mass	367.06920175
Topological Polar Surface Area	144 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	692
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
HY-N14167	Ekatetrone

Ekatetrone

Chemical Information

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