Arcyriaflavin A

CAT: 0024-sc-202470ASize: 10 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-202470ASize:10 mg

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CAS Number

118458-54-1

Chemical Information

Arcyriaflavin A

LSM-3627 is an indolocarbazole.

CAS Number	118458-54-1
PubChem CID	5327723
IUPAC Name	3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4,6,8,10,15,17,19,21-nonaene-12,14-dione
Molecular Formula	C20H11N3O2
Molecular Weight	325.3
XLogP	3.6
Topological Polar Surface Area	77.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	25
Formal Charge	0
Complexity	570

SMILES

C1=CC=C2C(=C1)C3=C4C(=C5C6=CC=CC=C6NC5=C3N2)C(=O)NC4=O

InChI

InChI=1S/C20H11N3O2/c24-19-15-13-9-5-1-3-7-11(9)21-17(13)18-14(16(15)20(25)23-19)10-6-2-4-8-12(10)22-18/h1-8,21-22H,(H,23,24,25)

InChIKey

KAJXOWFGKYKMMZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 118458-54-1

CID: 5327723

Formula: C20H11N3O2

MW: 325.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	325.3
XLogP3	3.6
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	325.085126602
Monoisotopic Mass	325.085126602
Topological Polar Surface Area	77.8 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	570
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

Catalog	Name
MBS5796686	Arcyriaflavin A
HY-103382R	Arcyriaflavin A (Standard)