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Acetylgitoxin structure
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Acetylgitoxin

TL;DR: Acetylgitoxin (CAS 11021-15-1) is a chemical compound with molecular formula C43H66O15 and molecular weight 822.4402 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[6-[6-[6-[[14,16-dihydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2-methyloxan-3-yl]oxy-3-hydroxy-2-methyloxan-4-yl] acetate

Also Known As: Acetylgitoxin, Digithapsin A, Acetylgitoxin-alpha, Desglucolanatoside B, Gitoxin, 3'''-acetate

CAS Number
11021-15-1
Molecular Formula
C43H66O15
Molecular Weight
822.4402 g/mol
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Technical Specifications

Molecular FormulaC43H66O15
Molecular Weight822.4402 g/mol
XLogP2.1
Topological Polar Surface Area (TPSA)209.0 Ų
Hydrogen Bond Donors5
Hydrogen Bond Acceptors15
Rotatable Bonds9
Exact Mass822.4402 Da
Heavy Atoms58
Complexity1560.0
SMILESCC1C(C(CC(O1)OC2C(OC(CC2O)OC3C(OC(CC3O)OC4CCC5(C(C4)CCC6C5CCC7(C6(CC(C7C8=CC(=O)OC8)O)O)C)C)C)C)OC(=O)C)O
InChIKeyPTTCKAPHKAXOPN-UHFFFAOYSA-N

Product Description

Applications: Acetylgitoxin is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A fine chemical supplied by CoreyChem, Acetylgitoxin (CAS 11021-15-1) has the molecular formula C43H66O15 and a molecular weight of 822.44 g/mol. Synonyms include Acetylgitoxin and Digithapsin A.

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 Acetylgitoxin

XLogP
2.1
TPSA (Topological Polar Surface Area)
209.0
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
15
Rotatable Bonds
9
Heavy Atoms
58
Complexity
1560.0
Exact Mass
822.4402
Monoisotopic Mass
822.4402
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 Acetylgitoxin

The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetylgitoxin. The TPSA of 209.0 Ų indicates high polarity, suggesting Acetylgitoxin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acetylgitoxin has 5 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Acetylgitoxin?

The CAS number of Acetylgitoxin is 11021-15-1.

What is the molecular formula of Acetylgitoxin?

The molecular formula of Acetylgitoxin is C43H66O15.

What is the molecular weight of Acetylgitoxin?

The molecular weight of Acetylgitoxin is 822.4402 g/mol.

What are the applications of Acetylgitoxin?

Acetylgitoxin is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Where can I buy Acetylgitoxin?

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

Does CoreyChem offer custom synthesis for Acetylgitoxin?

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

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