Prodigiosin HCl 0.5mg

CAT: 0628-A20938-0.5Size: 0.5 mgDry Ice: NoHazardous: No

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CAT#:0628-A20938-0.5Size:0.5 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

56144-17-3

Chemical Information

Prodigiosin hydrochloride

CAS Number	56144-17-3
PubChem CID	136179593
IUPAC Name	(2Z)-3-methoxy-2-[(5-methyl-4-pentyl-1H-pyrrol-2-yl)methylidene]-5-(1H-pyrrol-2-yl)pyrrole;hydrochloride
Molecular Formula	C20H26ClN3O
Molecular Weight	359.9
Topological Polar Surface Area	53.2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Heavy Atom Count	25
Formal Charge	0
Complexity	523

SMILES

CCCCCC1=C(NC(=C1)/C=C\2/C(=CC(=N2)C3=CC=CN3)OC)C.Cl

InChI

InChI=1S/C20H25N3O.ClH/c1-4-5-6-8-15-11-16(22-14(15)2)12-19-20(24-3)13-18(23-19)17-9-7-10-21-17;/h7,9-13,21-22H,4-6,8H2,1-3H3;1H/b19-12-;

InChIKey

UQRGJSTXVCWXNU-JHMJKTBASA-N

Chemical Structure

2D Structure

CAS: 56144-17-3

CID: 136179593

Formula: C20H26ClN3O

MW: 359.9

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	359.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Exact Mass	359.1764402
Monoisotopic Mass	359.1764402
Topological Polar Surface Area	53.2 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	523
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
P094-0.5MG	Prodigiosin
HY-100711A-01	Prodigiosin (hydrochloride)