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enniatin A1

CAS 4530-21-6C35H61N3O9MW 667.9

enniatin A1 (CAS 4530-21-6) — formula C35H61N3O9, molecular weight 667.9; category organic chemicals.

Product Overview

CAS Number4530-21-6
Molecular FormulaC35H61N3O9
Molecular Weight667.9
LogP7.3
ApplicationsUses: Enniatins are mycotoxins that appear in nature as a mixture of cyclohexadepsipeptides produced by bacteria, fungi, and plants. They may be found in contaminated cereal crops. (L1965, A3055)
CategoryOrganic Chemicals

Applications

Documented applications: Uses: Enniatins are mycotoxins that appear in nature as a mixture of cyclohexadepsipeptides produced by bacteria, fungi, and plants. They may be found in contaminated cereal crops. (L1965, A3055).

Technical Profile

What this product is

enniatin A1 is a carbon-based organic compound with CAS registry number 4530-21-6 and molecular formula C35H61N3O9 (molecular weight 667.9), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 4530-21-6

Its molecular formula C35H61N3O9 comprises 35 C, 61 H, 3 N, 9 O atoms.

Also known as: enniatin A1 · 恩镰孢菌素A1

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of enniatin A1?

The CAS registry number of enniatin A1 is 4530-21-6.

What is the molecular formula and molecular weight of enniatin A1?

Molecular formula C35H61N3O9, molecular weight 667.9.

What other names is enniatin A1 known by?

It is also registered under: enniatin A1, 恩镰孢菌素A1.

What are the documented applications of enniatin A1?

Recorded applications: Uses: Enniatins are mycotoxins that appear in nature as a mixture of cyclohexadepsipeptides produced by bacteria, fungi, and plants. They may be found in contaminated cereal crops. (L1965, A3055).

Which category does enniatin A1 belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for enniatin A1 (CAS 4530-21-6), compiled from public chemistry databases.

Registry identifiers across databases

CAS 号4530-21-6
PubChem CID57339253
分子式C35H61N3O9
IUPAC 名称(3S,6R,9S,12R,15S,18R)-3,9-bis[(2S)-butan-2-yl]-4,10,16-trimethyl-6,12,15,18-tetra(propan-2-yl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone
UNII(FDA)39458RI529

Computed descriptors

Molecular Weight667.9
XLogP37.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count8
Exact Mass667.44078053
Monoisotopic Mass667.44078053
Topological Polar Surface Area140
Heavy Atom Count47

Synonyms and trade names

Enniatin A1; 4530-21-6; UNII-39458RI529; 39458RI529; CHEBI:64652; DTXSID50891864; RefChem:136942; DTXCID701031285; Enniatin?A1; orb1709761; C35H61N3O9; MFCD14635385; MSK001559; AKOS040733105; BE162721; DA-63206

GHS hazard classification

已通报的危害声明H301, H311, H331 (41.8%)

What the public record says

恩镰孢菌素A1 · CAS 4530-21-6 · C35H61N3O9. UNII 39458RI529.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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