Products for Research Use Only
RegisterLogin

CDDO-TFEA

CAT: 0607-C4354-1Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0607-C4354-1Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Nrf2 activator
CAS Number
932730-52-4
Product Name Alternative
2-cyano-3,12-dioxo-N-(2,2,2-trifluoroethyl)-oleana-1,9(11)-dien-28-amide
Sequence
CDDO-Trifluoethyl Amide,RTA 404,TP-500
Field of Research
Apoptosis KEAP1-Nrf2
Purity
≥ 95.00%
Form
A crystalline solid
Solubility
≤5mg/ml in ethanol;5mg/ml in DMSO;5mg/ml in dimethyl formamide
Smiles
CC1(CC[C@@]2(CC[C@@](C)([C@@]3(CC[C@]4(C(C)(C(C(C#N)=C[C@@]4(C3=CC5=O)C)=O)C)[H])C)[C@]5([C@@]2(C1)[H])[H])C(NCC(F)(F)F)=O)C
Molecular Formula
C33H43F3N2O3
Molecular Weight
572.7
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Cddo-tfea
CAS Number932730-52-4
PubChem CID17756663
IUPAC Name(4aS,6aR,6bS,8aR,12aS,14aR,14bS)-11-cyano-2,2,6a,6b,9,9,12a-heptamethyl-10,14-dioxo-N-(2,2,2-trifluoroethyl)-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxamide
Molecular FormulaC33H43F3N2O3
Molecular Weight572.7
XLogP7.3
Topological Polar Surface Area87
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Heavy Atom Count41
Formal Charge0
Complexity1330
SMILES
C[C@@]12CC[C@]3(CCC(C[C@H]3[C@H]1C(=O)C=C4[C@]2(CC[C@@H]5[C@@]4(C=C(C(=O)C5(C)C)C#N)C)C)(C)C)C(=O)NCC(F)(F)F
InChI
InChI=1S/C33H43F3N2O3/c1-27(2)10-12-32(26(41)38-18-33(34,35)36)13-11-31(7)24(20(32)16-27)21(39)14-23-29(5)15-19(17-37)25(40)28(3,4)22(29)8-9-30(23,31)6/h14-15,20,22,24H,8-13,16,18H2,1-7H3,(H,38,41)/t20-,22-,24-,29-,30+,31+,32-/m0/s1
InChIKey
UBRASLQCAYTTEB-KPOXMGGZSA-N
Chemical Structure
2D Structure
2D structure of Cddo-tfea
CAS: 932730-52-4
CID: 17756663
Formula: C33H43F3N2O3
MW: 572.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight572.7
XLogP37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Exact Mass572.32257772
Monoisotopic Mass572.32257772
Topological Polar Surface Area87 Ų
Heavy Atom Count41
Formal Charge0
Complexity1330
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
BA8618-25CDDO-EA
BA3407-50CDDO-Im
BA8618-5CDDO-EA
BA8619-1CDDO-dhTFEA
BA8619-25CDDO-dhTFEA
BA3407-100CDDO-Im
BA8619-50CDDO-dhTFEA
BA3407-5.1CDDO-Im
BA8618-5.1CDDO-EA
BA8618-1CDDO-EA

Alternative Products

CatalogName
HY-130495-01CDDO-TFEA
M24402-01CDDO-Im
MBS3614749-01CDDO-EA
MBS3844204-01CDDO-dhTFEA
574500CDDO Imidazolide
abx283437-01CDDO-Me
MBS386703-01Bardoxolone (CDDO)
254913CDDO Im

Popular Products