Products for Research Use Only

Cladospolide D

CAT: 0013-GTR19254879-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19254879-02Size:50 mg
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Description
Cladospolide D is found in the Cladosporium sp. FT-0012 strain and exhibits activity against certain fungi.
CAS Number
371229-61-7
Field of Research
Infectious Disease & Virology
Smiles
C[C@H]1CCCCC[C@H] (C (=O) /C=C/C (=O) O1) O
Molecular Formula
C12H18O4
Molecular Weight
226.269
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Cladospolide D

Cladospolide D is a macrolide.

CAS Number371229-61-7
PubChem CID10966200
IUPAC Name(3E)-6-hydroxy-12-methyl-1-oxacyclododec-3-ene-2,5-dione
Molecular FormulaC12H18O4
Molecular Weight226.27
XLogP1.7
Topological Polar Surface Area63.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count16
Formal Charge0
Complexity283
SMILES
CC1CCCCCC(C(=O)/C=C/C(=O)O1)O
InChI
InChI=1S/C12H18O4/c1-9-5-3-2-4-6-10(13)11(14)7-8-12(15)16-9/h7-10,13H,2-6H2,1H3/b8-7+
InChIKey
OFRQIORIBGXHBF-BQYQJAHWSA-N
Chemical Structure
2D Structure
2D structure of Cladospolide D
CAS: 371229-61-7
CID: 10966200
Formula: C12H18O4
MW: 226.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight226.27
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass226.12050905
Monoisotopic Mass226.12050905
Topological Polar Surface Area63.6 Ų
Heavy Atom Count16
Formal Charge0
Complexity283
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes