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Bufogenin B structure
Fine Chemical

Bufogenin B

TL;DR: Bufogenin B (CAS 496-74-2) is a chemical compound with molecular formula C24H34O5 and molecular weight 402.24063 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-[(3S,5R,10S,13R,14S,16S,17R)-3,14,16-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one

Also Known As: Bufogenin B, Desacetylbufotalin, 16-beta-Hydroxybufalin, KST-1A5046, (3

CAS Number
496-74-2
Molecular Formula
C24H34O5
Molecular Weight
402.24063 g/mol
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Technical Specifications

Molecular FormulaC24H34O5
Molecular Weight402.24063 g/mol
XLogP2.2
Topological Polar Surface Area (TPSA)87.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors5
Rotatable Bonds1
Exact Mass402.24063 Da
Heavy Atoms29
Complexity773.0
SMILESC[C@]12CC[C@@H](C[C@H]1CCC3C2CC[C@]4([C@@]3(C[C@@H]([C@@H]4C5=COC(=O)C=C5)O)O)C)O
InChIKeyMWFCMSURKYLINK-DMQWCLGJSA-N

Product Description

Applications: Bufogenin B is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Bufogenin B (CAS 496-74-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Bufogenin B (CAS 496-74-2) is a fine chemical with the molecular formula C24H34O5 and a molecular weight of 402.24 g/mol. It is also known as Bufogenin B and Desacetylbufotalin.

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 Bufogenin B

XLogP
2.2
TPSA (Topological Polar Surface Area)
87.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
Rotatable Bonds
1
Heavy Atoms
29
Complexity
773.0
Exact Mass
402.24063
Monoisotopic Mass
402.24063
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 Bufogenin B

The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bufogenin B. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bufogenin B. Following Lipinski's Rule of Five, Bufogenin B has 3 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 Bufogenin B?

The CAS number of Bufogenin B is 496-74-2.

What is the molecular formula of Bufogenin B?

The molecular formula of Bufogenin B is C24H34O5.

What is the molecular weight of Bufogenin B?

The molecular weight of Bufogenin B is 402.24063 g/mol.

What are the applications of Bufogenin B?

Bufogenin B is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Bufogenin B (CAS 496-74-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS...

Where can I buy Bufogenin B?

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

Does CoreyChem offer custom synthesis for Bufogenin B?

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

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