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Syringostatin A structure
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Syringostatin A

TL;DR: Syringostatin A (CAS 125051-66-3) is a chemical compound with molecular formula C50H87ClN12O18 and molecular weight 1178.595 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(9Z)-21,24-bis(2-aminoethyl)-15-(3-aminopropyl)-3-(2-chloro-1-hydroxyethyl)-9-ethylidene-12-(1-hydroxyethyl)-18-(2-hydroxyethyl)-27-(3-hydroxytetradecanoylamino)-2,5,8,11,14,17,20,23,26-nonaoxo-1-oxa-4,7,10,13,16,19,22,25-octazacyclooctacos-6-yl]-2-hydroxyacetic acid

Also Known As: Syringostatin A, 2-[(9Z)-21,24-bis(2-aminoethyl)-15-(3-aminopropyl)-3-(2-chloro-1-hydroxyethyl)-9-ethylidene-12-(1-hydroxyethyl)-18-(2-hydroxyethyl)-27-(3-hydroxytetradecanoylamino)-2,5,8,11,14,17,20,23,26-nonaoxo-1-oxa-4,7,10,13,16,19,22,25-octazacyclooctacos-6-yl]-2-hydroxyacetic acid, 2-((9Z)-21,24-bis(2-aminoethyl)-15-(3-aminopropyl)-3-(2-chloro-1-hydroxyethyl)-9-ethylidene-12-(1-hydroxyethyl)-18-(2-hydroxyethyl)-27-(3-hydroxytetradecanoylamino)-2,5,8,11,14,17,20,23,26-nonaoxo-1-oxa-4,7,10,13,16,19,22,25-octazacyclooctacos-6-yl)-2-hydroxyacetic acid

CAS Number
125051-66-3
Molecular Formula
C50H87ClN12O18
Molecular Weight
1178.595 g/mol
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Technical Specifications

Molecular FormulaC50H87ClN12O18
Molecular Weight1178.595 g/mol
XLogP-3.1
Topological Polar Surface Area (TPSA)505.0 Ų
Hydrogen Bond Donors18
Hydrogen Bond Acceptors21
Rotatable Bonds27
Exact Mass1178.595 Da
Heavy Atoms81
Complexity2090.0
SMILESCCCCCCCCCCCC(CC(=O)NC1COC(=O)C(NC(=O)C(NC(=O)/C(=C/C)/NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)CCN)CCN)CCO)CCCN)C(C)O)C(C(=O)O)O)C(CCl)O)O
InChIKeySOKGGVHELUKAFO-SDYNXESYSA-N

Chemical Property Profile of Syringostatin A

XLogP
-3.1
TPSA (Topological Polar Surface Area)
505.0
Hydrogen Bond Donors
18
Hydrogen Bond Acceptors
21
Rotatable Bonds
27
Heavy Atoms
81
Complexity
2090.0
Exact Mass
1178.595
Monoisotopic Mass
1178.595
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 Syringostatin A

The XLogP value of -3.1 indicates that Syringostatin A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 505.0 Ų indicates high polarity, suggesting Syringostatin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Syringostatin A has 18 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Syringostatin A?

The CAS number of Syringostatin A is 125051-66-3.

What is the molecular formula of Syringostatin A?

The molecular formula of Syringostatin A is C50H87ClN12O18.

What is the molecular weight of Syringostatin A?

The molecular weight of Syringostatin A is 1178.595 g/mol.

Where can I buy Syringostatin A?

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

Does CoreyChem offer custom synthesis for Syringostatin A?

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

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