Cytochalasin E - ≥99% , CAS No.36011-19-5

CAS: 36011-19-5 Cat. No.: C1423603 Molecular Weight: 495.56 Beilstein Registry Number: 1096975 EC Number: 252-835-7 PubChem CID: 5458385

GRADE & PURITY ≥99%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Cytochalasin E, an epoxide containing Aspergillus -derived fungal metabolite, inhibits angiogenesis and tumor growth. Cytochalasin E is a potent actin depolymerization agent, and it binds and caps the barbed end of actin filaments to prevent actin elongation.

Specifications

Specifications & Purity

≥99%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

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

Purity

≥99%

Names and Identifiers

• Canonical Smiles: CC1CC=CC2C3C(O3)(C(C4C2(C(=O)NC4CC5=CC=CC=C5)OC(=O)OC=CC(C1=O)(C)O)C)C
• IUPAC Name: (1S,5E,7R,9S,11E,13S,14S,16R,17S,18S,19S)-19-benzyl-7-hydroxy-7,9,16,17-tetramethyl-2,4,15-trioxa-20-azatetracyclo[11.8.0.01,18.014,16]henicosa-5,11-diene-3,8,21-trione
• InChIKey: LAJXCUNOQSHRJO-ZYGJITOWSA-N
• INCHI: 1S/C28H33NO7/c1-16-9-8-12-19-23-27(4,35-23)17(2)21-20(15-18-10-6-5-7-11-18)29-24(31)28(19,21)36-25(32)34-14-13-26(3,33)22(16)30/h5-8,10-14,16-17,19-21,23,33H,9,15H2,1-4H3,(H,29,31)/b12-8+,14-13+/t16-,17-,19-,20-,21-,23-,26+,27+,28+/m0/s1
• Isomeric SMILES: C[C@H]1C/C=C/[C@H]2[C@H]3[C@](O3)([C@H]([C@@H]4[C@]2(C(=O)N[C@H]4CC5=CC=CC=C5)OC(=O)O/C=C/[C@@](C1=O)(C)O)C)C
• WGK Germany: 3
• RTECS: HA5360000
• PubChem CID: 5458385
• Molecular Weight: 495.56
• Beilstein: 1096975

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Alkaloids and derivatives
    • Class Cytochalasans

• Kingdom: Organic compounds
• Superclass: Alkaloids and derivatives
• Class: Cytochalasans
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Cytochalasans
• Alternative Parents: Macrolactams Isoindolones Oxepanes Pyrrolidine-2-ones Acyloins Benzene and substituted derivatives Carbonic acid diesters Tertiary alcohols Enol esters Secondary carboxylic acid amides Cyclic ketones Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Epoxides Organic oxides Organopnictogen compounds Hydrocarbon derivatives Organonitrogen compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Cytoglobosin skeleton - Cytochalasan - Macrolactam - Isoindolone - Isoindoline - Isoindole or derivatives - Oxepane - Monocyclic benzene moiety - Carbonic acid diester - Benzenoid - Acyloin - 2-pyrrolidone - Pyrrolidone - Enol ester - Tertiary alcohol - Pyrrolidine - Carboxamide group - Cyclic ketone - Ketone - Lactam - Secondary carboxylic acid amide - Carbonic acid derivative - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Ether - Oxirane - Oxacycle - Dialkyl ether - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Alcohol - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as cytochalasans. These are fungal metabolites structurally characterized by the presence of an isoindolone nucleus fused to a macrocyclic ring, which can either a lactone, as in cytochalasin B, a carbonate, as in cytochalasin E, or a carbocycle, as in cytochalasin D, H, and K.
• External Descriptors: cytochalasan alkaloid

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