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Stauprimide

CAT: 0931-T16941-03Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T16941-03Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
154589-96-5
Target
Others, c-Myc, Autophagy
Related Pathways
Autophagy, Cell Cycle/Checkpoint, Others
Bioactivity
Stauprimide is a non-broad spectrum inhibitor that binds to the MYC transcription factor NME2 and blocks its nuclear localization in ESCs, which causes down-regulation of MYC transcription.
Smiles
COC1C(CC2OC1(C)n1c3ccccc3c3c4C(=O)NC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1
Molecular Formula
C35H28N4O5
Molecular Weight
584.62
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Stauprimide
CAS Number154589-96-5
PubChem CID46245328
IUPAC NameN-[(2S,3R,4R,6R)-3-methoxy-2-methyl-16,18-dioxo-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-4-yl]-N-methylbenzamide
Molecular FormulaC35H28N4O5
Molecular Weight584.6
XLogP4.8
Topological Polar Surface Area94.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count44
Formal Charge0
Complexity1220
SMILES
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)C(=O)NC6=O)N(C)C(=O)C9=CC=CC=C9)OC
InChI
InChI=1S/C35H28N4O5/c1-35-31(43-3)23(37(2)34(42)18-11-5-4-6-12-18)17-24(44-35)38-21-15-9-7-13-19(21)25-27-28(33(41)36-32(27)40)26-20-14-8-10-16-22(20)39(35)30(26)29(25)38/h4-16,23-24,31H,17H2,1-3H3,(H,36,40,41)/t23-,24-,31-,35+/m1/s1
InChIKey
MQCCJEYZKWZQHU-MPRCCEKMSA-N
Chemical Structure
2D Structure
2D structure of Stauprimide
CAS: 154589-96-5
CID: 46245328
Formula: C35H28N4O5
MW: 584.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight584.6
XLogP34.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass584.20597001
Monoisotopic Mass584.20597001
Topological Polar Surface Area94.8 Ų
Heavy Atom Count44
Formal Charge0
Complexity1220
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes