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3,3'-Diindolylmethane

CAT: 0804-HY-15758-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-15758-01Size:100 mg
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Description
3,3'-Diindolylmethane is a strong, pure androgen receptor (AR) antagonist.
CAS Number
1968-05-4
Product Name Alternative
DIM; Arundine; HB 236
UNSPSC
12352005
Hazard Statement
H315, H319, H335, H413
Target
Androgen Receptor; Autophagy
Type
Natural Products
Related Pathways
Autophagy; Vitamin D Related/Nuclear Receptor
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/3,3_acute_-Diindolylmethane.html
Purity
99.93
Solubility
DMSO : ≥ 100 mg/mL
Smiles
C1(CC2=CNC3=C2C=CC=C3)=CNC4=C1C=CC=C4
Molecular Formula
C17H14N2
Molecular Weight
246.31
Precautions
H315, H319, H335, H413
References & Citations
[1]Le HT, et al. Plant-derived 3,3'-Diindolylmethane is a strong androgen antagonist in human prostate cancer cells. J Biol Chem. 2003 Jun 6;278 (23) :21136-45.|[2]Li XJ, et al. 3,3'-Diindolylmethane suppresses the growth of gastric cancer cells via activation of the Hippo signaling pathway. Oncol Rep. 2013 Nov;30 (5) :2419-26.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light, stored under nitrogen)
Scientific Category
Natural Products
Clinical Information
Phase 4

Chemical Information

3,3'-Diindolylmethane

3,3'-diindolylmethane is a member of indoles. It has a role as an antineoplastic agent and a P450 inhibitor.

CAS Number1968-05-4
PubChem CID3071
IUPAC Name3-(1H-indol-3-ylmethyl)-1H-indole
Molecular FormulaC17H14N2
Molecular Weight246.31
XLogP4.3
Topological Polar Surface Area31.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity286
SMILES
C1=CC=C2C(=C1)C(=CN2)CC3=CNC4=CC=CC=C43
InChI
InChI=1S/C17H14N2/c1-3-7-16-14(5-1)12(10-18-16)9-13-11-19-17-8-4-2-6-15(13)17/h1-8,10-11,18-19H,9H2
InChIKey
VFTRKSBEFQDZKX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,3'-Diindolylmethane
CAS: 1968-05-4
CID: 3071
Formula: C17H14N2
MW: 246.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight246.31
XLogP34.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass246.115698455
Monoisotopic Mass246.115698455
Topological Polar Surface Area31.6 Ų
Heavy Atom Count19
Formal Charge0
Complexity286
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

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