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Droseron

CAT: 0931-T82527-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T82527-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
478-40-0
Bioactivity
Droseron (compound 3), a natural product, can be isolated from Plumbago zeylanica L. [1].
Smiles
O=C1C(O)=C(C(=O)C=2C=CC=C(O)C12)C
Molecular Formula
C11H8O4
Molecular Weight
204.18
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Npc282043

Droserone is a hydroxy-1,4-naphthoquinone.

CAS Number478-40-0
PubChem CID442739
IUPAC Name4,8-dihydroxy-3-methylnaphthalene-1,2-dione
Molecular FormulaC11H8O4
Molecular Weight204.18
XLogP1.4
Topological Polar Surface Area74.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count15
Formal Charge0
Complexity356
SMILES
CC1=C(C2=C(C(=CC=C2)O)C(=O)C1=O)O
InChI
InChI=1S/C11H8O4/c1-5-9(13)6-3-2-4-7(12)8(6)11(15)10(5)14/h2-4,12-13H,1H3
InChIKey
KILMMLMKSQWMTN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Npc282043
CAS: 478-40-0
CID: 442739
Formula: C11H8O4
MW: 204.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight204.18
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass204.04225873
Monoisotopic Mass204.04225873
Topological Polar Surface Area74.6 Ų
Heavy Atom Count15
Formal Charge0
Complexity356
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
T124808-01Droserone

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CatalogName
GTR19217552-01Droseron

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