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Paeciloquinone F

CAT: 0931-TN10258-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-TN10258-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
162797-37-7
Target
EGFR
Related Pathways
Angiogenesis, Tyrosine Kinase/Adaptors, JAK/STAT signaling
Bioactivity
Paeciloquinone F inhibits EGFR (epidermal growth factor receptor) protein tyrosine kinase.
Smiles
O=C(O)C12OC(OC=3C=C4C(=O)C=5C=C(O)C=C(O)C5C(=O)C4=C(O)C31)(C)CC2
Molecular Formula
C20H14O9
Molecular Weight
398.32
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Paeciloquinone F

Paeciloquinone F is a member of hydroxyanthraquinones.

CAS Number162797-37-7
PubChem CID139584858
IUPAC Name(1S,17R)-3,7,9-trihydroxy-17-methyl-5,12-dioxo-16,20-dioxapentacyclo[15.2.1.02,15.04,13.06,11]icosa-2(15),3,6(11),7,9,13-hexaene-1-carboxylic acid
Molecular FormulaC20H14O9
Molecular Weight398.3
XLogP2.2
Topological Polar Surface Area151
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count1
Heavy Atom Count29
Formal Charge0
Complexity782
SMILES
C[C@]12CC[C@](O1)(C3=C(O2)C=C4C(=C3O)C(=O)C5=C(C4=O)C=C(C=C5O)O)C(=O)O
InChI
InChI=1S/C20H14O9/c1-19-2-3-20(29-19,18(26)27)14-11(28-19)6-9-13(17(14)25)16(24)12-8(15(9)23)4-7(21)5-10(12)22/h4-6,21-22,25H,2-3H2,1H3,(H,26,27)/t19-,20+/m1/s1
InChIKey
VFXZFYHLJCNYMX-UXHICEINSA-N
Chemical Structure
2D Structure
2D structure of Paeciloquinone F
CAS: 162797-37-7
CID: 139584858
Formula: C20H14O9
MW: 398.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight398.3
XLogP32.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count1
Exact Mass398.06378202
Monoisotopic Mass398.06378202
Topological Polar Surface Area151 Ų
Heavy Atom Count29
Formal Charge0
Complexity782
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
HY-N14635Paeciloquinone A
GTR19255803-01Paeciloquinone C
GTR19256088-01Paeciloquinone B
HY-N14638Paeciloquinone D
GTR19256063-01Paeciloquinone F
HY-N14639Paeciloquinone E

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