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Ferkuhinin

CAT: 0931-T124887-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T124887-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
408311-35-3
Target
Others
Related Pathways
Others
Bioactivity
Ferkuhinin is a useful organic compound for research related to life sciences. The catalog number is T124887 and the CAS number is 408311-35-3.
Smiles
[H][C@@]12[C@H](C[C@@]3(C)O[C@H]3C[C@@]1(C)[C@H](C[C@@]2(O)C(C)C)OC(C)=O)OC(=O)c1ccc(OC)cc1
Molecular Formula
C25H34O7
Molecular Weight
446.54
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Ferkuhinin
CAS Number408311-35-3
PubChem CID15521940
IUPAC Name[(1aS,2aR,3S,5R,5aS,6S,7aR)-3-acetyloxy-5-hydroxy-2a,7a-dimethyl-5-propan-2-yl-2,3,4,5a,6,7-hexahydro-1aH-azuleno[6,7-b]oxiren-6-yl] 4-methoxybenzoate
Molecular FormulaC25H34O7
Molecular Weight446.5
XLogP3.8
Topological Polar Surface Area94.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count32
Formal Charge0
Complexity745
SMILES
CC(C)[C@@]1(C[C@@H]([C@]2([C@H]1[C@H](C[C@@]3([C@H](C2)O3)C)OC(=O)C4=CC=C(C=C4)OC)C)OC(=O)C)O
InChI
InChI=1S/C25H34O7/c1-14(2)25(28)13-19(30-15(3)26)23(4)12-20-24(5,32-20)11-18(21(23)25)31-22(27)16-7-9-17(29-6)10-8-16/h7-10,14,18-21,28H,11-13H2,1-6H3/t18-,19-,20-,21+,23-,24+,25+/m0/s1
InChIKey
SWCJHPGZGVBMFG-TZIRWMJISA-N
Chemical Structure
2D Structure
2D structure of Ferkuhinin
CAS: 408311-35-3
CID: 15521940
Formula: C25H34O7
MW: 446.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight446.5
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass446.23045342
Monoisotopic Mass446.23045342
Topological Polar Surface Area94.6 Ų
Heavy Atom Count32
Formal Charge0
Complexity745
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

Alternative Products

CatalogName
GTR19228825-01Ferkuhinin

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