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Lophanthoidin E

CAT: 1459-CS-BT-00418Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-BT-00418Size:1 Each
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Description
Lophanthoidin E is listed under Pesticide Standards and is intended for analytical research, quality control and pharmaceutical reference standard applications. The product is supplied by Clearsynth under CAT No. CS-BT-00418. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
120462-45-5
Synonyms
Lophanthoidin E
Molecular Formula
C 22 H 30 O 7
Molecular Weight
406.47
Additionnal Information
Lophanthoidin E is supplied with detailed characterization data compliant with regulatory guideline. Lophanthoidin E can be used for analytical method development, method validation (AMV), Quality Control (QC), ANDA-related analytical work, and commercial pharmaceutical research applications.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

Lophanthoidin E

Lophanthoidin E has been reported in Isodon lophanthoides with data available.

CAS Number120462-45-5
PubChem CID14193977
IUPAC Name2-(1,9,10-trihydroxy-4b,8,8-trimethyl-3,4-dioxo-5,6,7,8a,9,10-hexahydrophenanthren-2-yl)propyl acetate
Molecular FormulaC22H30O7
Molecular Weight406.5
XLogP1.5
Topological Polar Surface Area121
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count29
Formal Charge0
Complexity834
SMILES
CC(COC(=O)C)C1=C(C2=C(C(=O)C1=O)C3(CCCC(C3C(C2O)O)(C)C)C)O
InChI
InChI=1S/C22H30O7/c1-10(9-29-11(2)23)12-15(24)13-14(18(27)16(12)25)22(5)8-6-7-21(3,4)20(22)19(28)17(13)26/h10,17,19-20,24,26,28H,6-9H2,1-5H3
InChIKey
NHVNNHGOOVAQDU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Lophanthoidin E
CAS: 120462-45-5
CID: 14193977
Formula: C22H30O7
MW: 406.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight406.5
XLogP31.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass406.19915329
Monoisotopic Mass406.19915329
Topological Polar Surface Area121 Ų
Heavy Atom Count29
Formal Charge0
Complexity834
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count5
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
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MBS3617769-01Lophanthoidin B

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