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Cladosporin

CAT: 0572-TRC-C557550-0.5MGSize: 0.5 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-C557550-0.5MGSize:0.5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
35818-31-6
Synonyms
[2R-[2alpha(R*),6beta]]-3,4-dihydro-6,8-dihydroxy-3-[(tetrahydro-6-methyl-2H-pyran-2-yl)methyl]-1H-2-Benzopyran-1-one; (3R)-3,4-Dihydro-6,8-dihydroxy-3-[[(2R,6S)-tetrahydro-6-methyl-2H-pyran-2-yl]methyl]-1H-2-benzopyran-1-one; Asperentin
Hazard Statement
Not a hazardous substance according to GHS.
Purity
>95% (HPLC)
Smiles
C[C@H]1CCC[C@H](C[C@H]2Cc3cc(O)cc(O)c3C(=O)O2)O1
Molecular Formula
C16H20O5
Molecular Weight
292.33
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Cladosporin

cladosporin has been reported in Aspergillus flavus, Chaetomium globosum, and Cladosporium cladosporioides with data available.

CAS Number35818-31-6
PubChem CID13990016
IUPAC Name(3R)-6,8-dihydroxy-3-[[(2R,6S)-6-methyloxan-2-yl]methyl]-3,4-dihydroisochromen-1-one
Molecular FormulaC16H20O5
Molecular Weight292.33
XLogP3.3
Topological Polar Surface Area76
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity385
SMILES
C[C@H]1CCC[C@@H](O1)C[C@H]2CC3=C(C(=CC(=C3)O)O)C(=O)O2
InChI
InChI=1S/C16H20O5/c1-9-3-2-4-12(20-9)8-13-6-10-5-11(17)7-14(18)15(10)16(19)21-13/h5,7,9,12-13,17-18H,2-4,6,8H2,1H3/t9-,12+,13+/m0/s1
InChIKey
WOMKDMUZNBFXKG-ZWKOPEQDSA-N
Chemical Structure
2D Structure
2D structure of Cladosporin
CAS: 35818-31-6
CID: 13990016
Formula: C16H20O5
MW: 292.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight292.33
XLogP33.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass292.13107373
Monoisotopic Mass292.13107373
Topological Polar Surface Area76 Ų
Heavy Atom Count21
Formal Charge0
Complexity385
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-136767-01Cladosporin

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