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ALRT 1550

CAT: 0013-GTR19198267-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19198267-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
ALRT 1550
CAS Number
178600-20-9
Field of Research
Metabolism Research
Smiles
C (=C\C=C\C (=C\C (O) =O) \C) (\C) /C1=CC (C (C) (C) C) =CC (C (C) (C) C) =C1
Molecular Formula
C23H32O2
Molecular Weight
340.5
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Alrt-1550

LGD-1550 is an orally-active synthetic aromatic retinoic acid agent with potential antineoplastic and chemopreventive activities.

CAS Number178600-20-9
PubChem CID5287705
IUPAC Name(2E,4E,6E)-7-(3,5-ditert-butylphenyl)-3-methylocta-2,4,6-trienoic acid
Molecular FormulaC23H32O2
Molecular Weight340.5
XLogP7.8
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Heavy Atom Count25
Formal Charge0
Complexity528
SMILES
C/C(=C\C(=O)O)/C=C/C=C(\C)/C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C
InChI
InChI=1S/C23H32O2/c1-16(12-21(24)25)10-9-11-17(2)18-13-19(22(3,4)5)15-20(14-18)23(6,7)8/h9-15H,1-8H3,(H,24,25)/b10-9+,16-12+,17-11+
InChIKey
JMPZTWDLOGTBPM-OUQSKUGOSA-N
Chemical Structure
2D Structure
2D structure of Alrt-1550
CAS: 178600-20-9
CID: 5287705
Formula: C23H32O2
MW: 340.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight340.5
XLogP37.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass340.240230259
Monoisotopic Mass340.240230259
Topological Polar Surface Area37.3 Ų
Heavy Atom Count25
Formal Charge0
Complexity528
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count3
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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