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Cerbroside structure
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Cerbroside

TL;DR: Cerbroside (CAS 11005-70-2) is a chemical compound with molecular formula C42H66O18 and molecular weight 858.4249 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[(3S,5R,10S,13R,14S,17R)-14-hydroxy-3-[(2S,3R,4S,5R,6S)-5-hydroxy-4-methoxy-6-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one

Also Known As: Cerberoside, Cerbroside, Thevetin B, Cerberosid, Cerberosid [German]

CAS Number
11005-70-2
Molecular Formula
C42H66O18
Molecular Weight
858.4249 g/mol
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Technical Specifications

Molecular FormulaC42H66O18
Molecular Weight858.4249 g/mol
XLogP-1.6
Topological Polar Surface Area (TPSA)273.0 Ų
Hydrogen Bond Donors9
Hydrogen Bond Acceptors18
Rotatable Bonds10
Exact Mass858.4249 Da
Heavy Atoms60
Complexity1570.0
SMILESC[C@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CCC4C3CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O)O)OC)O
InChIKeyQWNHCYWCKDKDMK-WKTATXSHSA-N

Product Description

Applications: Cerbroside is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Cerbroside (CAS 11005-70-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Cerbroside (CAS 11005-70-2) is a fine chemical with the molecular formula C42H66O18 and a molecular weight of 858.42 g/mol. It is also known as Cerberoside and Cerbroside.

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 Cerbroside

XLogP
-1.6
TPSA (Topological Polar Surface Area)
273.0
Hydrogen Bond Donors
9
Hydrogen Bond Acceptors
18
Rotatable Bonds
10
Heavy Atoms
60
Complexity
1570.0
Exact Mass
858.4249
Monoisotopic Mass
858.4249
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 Cerbroside

The XLogP value of -1.6 indicates that Cerbroside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 273.0 Ų indicates high polarity, suggesting Cerbroside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cerbroside has 9 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Cerbroside?

The CAS number of Cerbroside is 11005-70-2.

What is the molecular formula of Cerbroside?

The molecular formula of Cerbroside is C42H66O18.

What is the molecular weight of Cerbroside?

The molecular weight of Cerbroside is 858.4249 g/mol.

What are the applications of Cerbroside?

Cerbroside is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Cerbroside (CAS 11005-70-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS...

Where can I buy Cerbroside?

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

Does CoreyChem offer custom synthesis for Cerbroside?

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

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