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(2R) -Norpterosin B

CAT: 0804-HY-N3174Size: 1 EachDry Ice: NoHazardous: No
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Description
(2R) -Norpterosin B is a sesquiterpenoid isolated from Pteris semipinnata[1].
CAS Number
1226892-20-1
UNSPSC
12352005
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/2r-norpterosin-b.html
Solubility
10 mM in DMSO
Smiles
CC1=C2C(C[C@@H](C)C2=O)=CC(C)=C1CO
Molecular Formula
C13H16O2
Molecular Weight
204.26
References & Citations
[1]Zha-Jun Zhan, et al. Three New Illudalane Sequiterpenoids from Pteris semipinnata.Volume93, Issue3, March 2010, Pages 550-554.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Norpterosin B
CAS Number1226892-20-1
PubChem CID101494967
IUPAC Name(2R)-6-(hydroxymethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one
Molecular FormulaC13H16O2
Molecular Weight204.26
XLogP2.1
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count15
Formal Charge0
Complexity261
SMILES
C[C@@H]1CC2=C(C1=O)C(=C(C(=C2)C)CO)C
InChI
InChI=1S/C13H16O2/c1-7-4-10-5-8(2)13(15)12(10)9(3)11(7)6-14/h4,8,14H,5-6H2,1-3H3/t8-/m1/s1
InChIKey
FUOYIVLWRSGBHK-MRVPVSSYSA-N
Chemical Structure
2D Structure
2D structure of Norpterosin B
CAS: 1226892-20-1
CID: 101494967
Formula: C13H16O2
MW: 204.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight204.26
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass204.115029749
Monoisotopic Mass204.115029749
Topological Polar Surface Area37.3 Ų
Heavy Atom Count15
Formal Charge0
Complexity261
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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