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Z-Indirubin

CAT: 1134-ESS0390-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1134-ESS0390-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
906748-38-7
Structure Composition
C 73.27% H 3.84% N 10.68% O 12.20%
UDF Signal Word
NONE
Hazard Statement
Not dangerous goods.
Applications
Synthetic analog of a natural compound from Isatis Leaf as well as a by-product of bacterial metabolysis
Molecular Formula
C16H10N2O2
Molecular Weight
262.2703
Packaging Group
Not Available. Not dangerous goods.
Shipping Conditions
Room temerature
Storage Conditions
Freezer @ -20ºC
Hazardous Class
Not dangerous goods.

Chemical Information

2H-Indol-2-one, 3-(1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,3-dihydro-

Indirubin is under investigation in clinical trial NCT01735864 (Dosage Determination Trial for Indigo Naturalis Extract in Oil Ointment).

CAS Number906748-38-7
PubChem CID10177
IUPAC Name2-(2-hydroxy-1H-indol-3-yl)indol-3-one
Molecular FormulaC16H10N2O2
Molecular Weight262.26
XLogP2.7
Topological Polar Surface Area65.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity448
SMILES
C1=CC=C2C(=C1)C(=C(N2)O)C3=NC4=CC=CC=C4C3=O
InChI
InChI=1S/C16H10N2O2/c19-15-10-6-2-4-8-12(10)17-14(15)13-9-5-1-3-7-11(9)18-16(13)20/h1-8,18,20H
InChIKey
JNLNPCNGMHKCKO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2H-Indol-2-one, 3-(1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,3-dihydro-
CAS: 906748-38-7
CID: 10177
Formula: C16H10N2O2
MW: 262.26
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight262.26
XLogP32.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass262.074227566
Monoisotopic Mass262.074227566
Topological Polar Surface Area65.5 Ų
Heavy Atom Count20
Formal Charge0
Complexity448
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-N0117A-01(Z) -Indirubin
HY-N0117AS-01(Z) -Indirubin-d4
HY-N0117AS1-01(Z) -Indirubin-d8
HY-N0117AR-01(Z) -Indirubin (Standard)
FI65043-01Indirubin

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