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Katsumadain A structure
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Katsumadain A

TL;DR: Katsumadain A (CAS 252239-83-1) is a chemical compound with molecular formula C32H28O4 and molecular weight 476.19876 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2S,4S)-2-(2-oxo-4-phenylbutyl)-4-phenyl-7-[(E)-2-phenylethenyl]-3,4-dihydro-2H-pyrano[3,2-c]pyran-5-one

Also Known As: katsumadain A, J1.233.569E, (2S)-3,4-Dihydro-2alpha-(2-oxo-4-phenylbutyl)-4beta-phenyl-7-(2-phenylethenyl)-2H,5H-pyrano[4,3-b]pyran-5-one, (2S,4S)-2-(2-oxo-4-phenylbutyl)-4-phenyl-7-(2-phenylethenyl)-2H,3H,4H,5H-pyrano[4,3-b]pyran-5-one, (2S,4S)-2-(2-oxo-4-phenylbutyl)-4-phenyl-7-[(E)-2-phenylethenyl]-3,4-dihydro-2H-pyrano[3,2-c]pyran-5-one

CAS Number
252239-83-1
Molecular Formula
C32H28O4
Molecular Weight
476.19876 g/mol
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Technical Specifications

Molecular FormulaC32H28O4
Molecular Weight476.19876 g/mol
XLogP6.2
Topological Polar Surface Area (TPSA)52.6 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds8
Exact Mass476.19876 Da
Heavy Atoms36
Complexity863.0
SMILESC1[C@H](OC2=C([C@@H]1C3=CC=CC=C3)C(=O)OC(=C2)/C=C/C4=CC=CC=C4)CC(=O)CCC5=CC=CC=C5
InChIKeyIAIGBNIWSBFKNA-FIACUDKOSA-N

Chemical Property Profile of Katsumadain A

XLogP
6.2
TPSA (Topological Polar Surface Area)
52.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
8
Heavy Atoms
36
Complexity
863.0
Exact Mass
476.19876
Monoisotopic Mass
476.19876
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Katsumadain A

The XLogP value of 6.2 indicates that Katsumadain A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Katsumadain A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Katsumadain A has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Katsumadain A?

The CAS number of Katsumadain A is 252239-83-1.

What is the molecular formula of Katsumadain A?

The molecular formula of Katsumadain A is C32H28O4.

What is the molecular weight of Katsumadain A?

The molecular weight of Katsumadain A is 476.19876 g/mol.

Where can I buy Katsumadain A?

You can request a quote for Katsumadain A directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Katsumadain A?

Yes, CoreyChem provides custom synthesis services for Katsumadain A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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