17397-89-6
Product Name:
CERULENIN
Formula:
C12H17NO3
Synonyms:
(2R,3S,E,E)-2,3-Epoxy-4-oxo-7,10-dodecadienamide;Cerulenin, Cephalosporium caerulens - CAS 17397-89-6 - Calbiochem
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Melting Point | 93.5 °C |
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Solubility | Slightly soluble |
LogP | 1.2 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H302:Acute toxicity,oral |
Precautionary Statement Codes |
P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P270:Do not eat, drink or smoke when using this product. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
Molecular Weight | 223.27 g/mol |
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XLogP3 | 0.8 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 7 |
Exact Mass | 223.12084340 g/mol |
Monoisotopic Mass | 223.12084340 g/mol |
Topological Polar Surface Area | 72.7 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 320 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 2 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 2 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Cerulenin is an epoxydodecadienamide isolated from several species, including Acremonium, Acrocylindrum and Helicoceras. It inhibits the biosynthesis of several lipids by interfering with enzyme function. It has a role as an antifungal agent, an antiinfective agent, an antilipemic drug, an antimetabolite, a fatty acid synthesis inhibitor and an antimicrobial agent. It is a monocarboxylic acid amide and an epoxide.