Nanchangmycin - ≥98% , CAS No.65101-87-3

CAS: 65101-87-3 Cat. No.: N276424 Molecular Weight: 889.1 PubChem CID: 86278937

GRADE & PURITY ≥98%

Synonyms

Nanchangmycin A | Sodium;(E,2S,4R,8S)-8-[(2S,5R,7S,8R,9R)-7-hydroxy-2-[(2R,4S,5S,7R,9S,10R)-2-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-9-[(2S,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxy-4,10-dimethyl-1,6-dioxaspiro[4.5]decan-7-yl]-2,8-

Storage

Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

Overview

Store at +4°C. Store under desiccating conditions. The product can be stored for up to 12 months.

Specifications

Synonyms

Nanchangmycin A | Sodium;(E, 2S, 4R, 8S)-8-[(2S, 5R, 7S, 8R, 9R)-7-hydroxy-2-[(2R, 4S, 5S, 7R, 9S, 10R)-2-[(2S, 3S, 5R, 6R)-6-hydroxy-6-(hydroxymethyl)-3, 5-dimethyloxan-2-yl]-9-[(2S, 5S, 6R)-5-methoxy-6-methyloxan-2-yl]oxy-4, 10-dimethyl-1, 6-dioxaspiro[4.5]decan-7-yl]-2, 8-

Specifications & Purity

≥98%

Biochemical and Physiological Mechanisms

Antibiotic. Polyether ionophore similar to dianemycin. Active against Gram-positive bacteria.

Storage

Store at -20°C, Desiccated

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504772478
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504772478
• Canonical Smiles: CC1CC(C(OC1C2CC(C3(O2)C(C(CC(O3)C4(CCC5(O4)CC(C(C(O5)C(C)C=C(C)C(=O)C(C)CC(C)C(=O)[O-])C)O)C)OC6CCC(C(O6)C)OC)C)C)(CO)O)C.[Na+]
• IUPAC Name: sodium;(E,2S,4R,8S)-8-[(2S,5R,7S,8R,9R)-7-hydroxy-2-[(2R,4S,5S,7R,9S,10R)-2-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-9-[(2S,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxy-4,10-dimethyl-1,6-dioxaspiro[4.5]decan-7-yl]-2,8-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]-2,4,6-trimethyl-5-oxonon-6-enoate
• InChIKey: XMAIRYYXDCNFKP-SEDNIUBGSA-M
• INCHI: 1S/C47H78O14.Na/c1-24(40(50)25(2)18-28(5)43(51)52)17-26(3)41-31(8)34(49)22-45(59-41)16-15-44(11,61-45)38-21-36(56-39-14-13-35(54-12)33(10)55-39)32(9)47(58-38)30(7)20-37(57-47)42-27(4)19-29(6)46(53,23-48)60-42;/h17,25-39,41-42,48-49,53H,13-16,18-23H2,1-12H3,(H,51,52);/q;+1/p-1/b24-17+;/t25-,26+,27+,28+,29-,30+,31-,32-,33-,34+,35+,36+,37-,38-,39-,41-,42+,44+,45-,46+,47+;/m1./s1
• Isomeric SMILES: C[C@H]1C[C@H]([C@@](O[C@@H]1[C@H]2C[C@@H]([C@@]3(O2)[C@@H]([C@H](C[C@@H](O3)[C@@]4(CC[C@@]5(O4)C[C@@H]([C@H]([C@H](O5)[C@@H](C)/C=C(\C)/C(=O)[C@H](C)C[C@H](C)C(=O)[O-])C)O)C)O[C@@H]6CC[C@@H]([C@H](O6)C)OC)C)C)(CO)O)C.[Na+]
• PubChem CID: 86278937
• Molecular Weight: 889.1

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Class Fatty Acyls
      • Subclass Fatty acids and conjugates

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Fatty Acyls
• Subclass: Fatty acids and conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Medium-chain fatty acids
• Alternative Parents: Hydroxy fatty acids Ketals Unsaturated fatty acids Oxanes Alpha-branched alpha,beta-unsaturated ketones Acryloyl compounds Oxolanes Enones Secondary alcohols Carboxylic acid salts Hemiacetals Ketones Oxacyclic compounds Carboxylic acids Dialkyl ethers Monocarboxylic acids and derivatives Primary alcohols Aldehydes Organic sodium salts Organic oxides Hydrocarbon derivatives Organic zwitterions
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Medium-chain fatty acid - Hydroxy fatty acid - Ketal - Oxane - Unsaturated fatty acid - Alpha-branched alpha,beta-unsaturated-ketone - Enone - Oxolane - Acryloyl-group - Alpha,beta-unsaturated ketone - Carboxylic acid salt - Hemiacetal - Ketone - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Acetal - Dialkyl ether - Monocarboxylic acid or derivatives - Organic alkali metal salt - Ether - Oxacycle - Alcohol - Organic oxygen compound - Organic sodium salt - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Aldehyde - Carbonyl group - Organic salt - Organic oxide - Organic zwitterion - Aliphatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

JEG-3 (107 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Solubility: DMSO 173 mg/mL (194.57 mM)，water <1 mg/mL (<1 mM)，Ethanol 173 mg/mL (194.57 mM)
• Molecular Weight: 889.100 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 13
• Exact Mass: 888.521 Da
• Monoisotopic Mass: 888.521 Da
• Topological Polar Surface Area: 192.000 Ų
• Heavy Atom Count: 62
• Formal Charge: 0
• Complexity: 1580.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 21
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 2

XLogP3

References

1. Yu-Si Yan, Li-Sha Zou, He-Geng Wei, Meng-Yao Yang, Yun-Qi Yang, Xiao-Fang Li, Hai-Yang Xia.  (2023)  An atypical two-component system, AtcR/AtcK, simultaneously regulates the biosynthesis of multiple secondary metabolites in Streptomyces bingchenggensis.  APPLIED AND ENVIRONMENTAL MICROBIOLOGY,      [PMID:38112424] [10.1128/aem.01300-23]