Streptonigrin 50mg

CAT: 0628-A18948-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0628-A18948-50Size:50 mg

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CAS Number

3930-19-6

Chemical Information

Streptonigrin

Streptonigrin is complex cytotoxic antibiotic obtained from Streptomyces flocculus or S. rufochronmogenus. It is used in advanced carcinoma and causes leukopenia. It has a role as an antimicrobial agent and an antineoplastic agent. It is a quinolone and a member of pyridines.

CAS Number	3930-19-6
PubChem CID	5298
IUPAC Name	5-amino-6-(7-amino-6-methoxy-5,8-dioxoquinolin-2-yl)-4-(2-hydroxy-3,4-dimethoxyphenyl)-3-methylpyridine-2-carboxylic acid
Molecular Formula	C25H22N4O8
Molecular Weight	506.5
XLogP	1.8
Topological Polar Surface Area	197
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	6
Heavy Atom Count	37
Formal Charge	0
Complexity	944

SMILES

CC1=C(C(=C(N=C1C(=O)O)C2=NC3=C(C=C2)C(=O)C(=C(C3=O)N)OC)N)C4=C(C(=C(C=C4)OC)OC)O

InChI

InChI=1S/C25H22N4O8/c1-9-14(10-6-8-13(35-2)23(36-3)20(10)30)15(26)19(29-17(9)25(33)34)12-7-5-11-18(28-12)22(32)16(27)24(37-4)21(11)31/h5-8,30H,26-27H2,1-4H3,(H,33,34)

InChIKey

PVYJZLYGTZKPJE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3930-19-6

CID: 5298

Formula: C25H22N4O8

MW: 506.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	506.5
XLogP3	1.8
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	6
Exact Mass	506.14376367
Monoisotopic Mass	506.14376367
Topological Polar Surface Area	197 Å²
Heavy Atom Count	37
Formal Charge	0
Complexity	944
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
T16946-01	Streptonigrin
MBS5814021	Streptonigrin (racemate)
GTR19198885-01	Methyl Streptonigrin
HY-124586A	(rac)-Streptonigrin
TRC-S687555-25MG	Streptonigrin from Streptomyces flocculus
TBI3484-1MG	Streptonigrin, Induces heterochromatin formation
TRC-S687560-25MG	Streptonigrin from Streptomyces flocculus (racemic)

Streptonigrin 50mg

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