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3,14-Dihydroxy-19-oxobufa-20,22-dienolide structure
Fine Chemical

3,14-Dihydroxy-19-oxobufa-20,22-dienolide

TL;DR: 3,14-Dihydroxy-19-oxobufa-20,22-dienolide (CAS 4980-53-4) is a chemical compound with molecular formula C24H32O5 and molecular weight 400.22498 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(3S,5S,10R,13R,14S,17R)-3,14-dihydroxy-13-methyl-17-(6-oxopyran-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-10-carbaldehyde

Also Known As: Bovogenin A, KST-1A5071, 3,14-Dihydroxy-19-oxobufa-20,22-dienolide, (3, A,5

CAS Number
4980-53-4
Molecular Formula
C24H32O5
Molecular Weight
400.22498 g/mol
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Technical Specifications

Molecular FormulaC24H32O5
Molecular Weight400.22498 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)83.8 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds2
Exact Mass400.22498 Da
Heavy Atoms29
Complexity786.0
SMILESC[C@]12CCC3C([C@]1(CC[C@@H]2C4=COC(=O)C=C4)O)CC[C@@H]5[C@@]3(CC[C@@H](C5)O)C=O
InChIKeySTSJQAAJJHGCMJ-NJAYUKRKSA-N

Product Description

Applications: 3,14-Dihydroxy-19-oxobufa-20,22-dienolide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 3,14-Dihydroxy-19-oxobufa-20,22-dienolide (CAS 4980-53-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

3,14-Dihydroxy-19-oxobufa-20,22-dienolide (CAS 4980-53-4) is a fine chemical with the molecular formula C24H32O5 and a molecular weight of 400.22 g/mol. It is also known as Bovogenin A and KST-1A5071.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 3,14-Dihydroxy-19-oxobufa-20,22-dienolide

XLogP
2.4
TPSA (Topological Polar Surface Area)
83.8
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
2
Heavy Atoms
29
Complexity
786.0
Exact Mass
400.22498
Monoisotopic Mass
400.22498
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 3,14-Dihydroxy-19-oxobufa-20,22-dienolide

The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,14-Dihydroxy-19-oxobufa-20,22-dienolide. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,14-Dihydroxy-19-oxobufa-20,22-dienolide. Following Lipinski's Rule of Five, 3,14-Dihydroxy-19-oxobufa-20,22-dienolide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3,14-Dihydroxy-19-oxobufa-20,22-dienolide?

The CAS number of 3,14-Dihydroxy-19-oxobufa-20,22-dienolide is 4980-53-4.

What is the molecular formula of 3,14-Dihydroxy-19-oxobufa-20,22-dienolide?

The molecular formula of 3,14-Dihydroxy-19-oxobufa-20,22-dienolide is C24H32O5.

What is the molecular weight of 3,14-Dihydroxy-19-oxobufa-20,22-dienolide?

The molecular weight of 3,14-Dihydroxy-19-oxobufa-20,22-dienolide is 400.22498 g/mol.

What are the applications of 3,14-Dihydroxy-19-oxobufa-20,22-dienolide?

3,14-Dihydroxy-19-oxobufa-20,22-dienolide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 3,14-Dihydroxy-19-oxobufa-20,22-dienolide (CAS 4980-53-4) with custom synthesis available from milligram to...

Where can I buy 3,14-Dihydroxy-19-oxobufa-20,22-dienolide?

You can request a quote for 3,14-Dihydroxy-19-oxobufa-20,22-dienolide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3,14-Dihydroxy-19-oxobufa-20,22-dienolide?

Yes, CoreyChem provides custom synthesis services for 3,14-Dihydroxy-19-oxobufa-20,22-dienolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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