Zearalanone
Grundinformationen
- CAS
5975-78-0- Standard-SMILES
C[C@H]1CCCC(=O)CCCCCc2cc(O)cc(O)c2C(=O)O1- InChIKey
APJDQUGPCJRQRJ-LBPRGKRZSA-N- Summenformel
- C18H24O5
- Durchschnittliche Molmasse
- 320,4 g/mol
- Monoisotopische Masse
- 320,16237386
Überblick
Zearalanone is a macrolide and a member of resorcinols.
Namen und Bezeichner
- Bevorzugter Name
- Zearalanone
- IUPAC
- (4S)-16,18-dihydroxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),15,17-triene-2,8-dione
- Englischer Name
- ZEARALANONE
- Summenformel
- C18H24O5
- Molmasse
- 320.38
Namen und Synonyme
Zearalanone(S)-Zearalanone5975-78-0ZanoneCCRIS 9235P 1502UNII-133DU2F2VS133DU2F2VS(S)-3,4,5,6,9,10,11,12-Octahydro-14,16-dihydroxy-3-methyl-1H-2-benzoxacyclotetradecin-1,7(8H)-dioneDTXSID6022395beta-Resorcylic acid, 6-(10-hydroxy-6-oxoundecyl)-, mu-lactoneP-1502
Weitere Namen anzeigen
Zearalanone solutionZearalanone StandardZearalanone in Methanol(S)-Zearalanone, P 1502, Zanone(S)-Zearalanone in Acetonitrile
1H-2-Benzoxacyclotetradecin-1,7(8H)-dione, 3,4,5,6,9,10,11,12-octahydro-14,16-dihydroxy-3-methyl-, (S)-(11S)-15,17-dihydroxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(18),14,16-triene-7,13-dione.BETA.-RESORCYLIC ACID, 6-(10-HYDROXY-6-OXOUNDECYL)-, .MU.-LACTONE1H-2-Benzoxacyclotetradecin-1,7(8H)-dione, 3,4,5,6,9,10,11,12-octahydro-14,16-dihydroxy-3-methyl-, (3S)-(11S)-15,17-dihydroxy-11-methyl-12-oxabicyclo(12.4.0)octadeca-1(18),14,16-triene-7,13-dioneRefChem:195890DTXCID502395APJDQUGPCJRQRJ-UHFFFAOYSA-N
Datenbank-Bezeichner
- CAS
5975-78-0
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,9
- Polarare Oberfläche (TPSA)
- 83,8 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 23
- Formalladung
- 0
- Komplexität
- 408
Experimentelle und physikochemische Eigenschaften
Endocrine DisruptorsPotential endocrine disrupting compound
Collision Cross Section178.19 Ų [M-H]-
Physikochemische Eigenschaften
- Schmelzpunkt
- 184 · 184-186°C
- Siedepunkt
- 576.8 · 576.8±50.0 °C(Predicted)
- Dichte
- 1.148 · 1.148±0.06 g/cm3(Predicted)
- Flammpunkt
- 2 ℃ · 2℃
- storage temp.
- -20 °C · -20°C
- Löslichkeit
- Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solid
- pka
- 7.83 · 7.83±0.40(Predicted)
- Farbe
- White to Off-White
- Major Application
- cleaning productscosmeticsfood and beveragespersonal care
- InChI
- 1S/C18H24O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h10-12,20-21H,2-9H2,1H3/t12-/m0/s1
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory InformationRegulation (EC) No 178/2002 (amended)
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Sicherheitsdaten
- wgk
- 3
- ridadr
- UN 1648 3 / PGII
- hs_code
- 29322090
- risk_code
- 20/21/22-36/37/38-40-36-11
- hazard_code
- Xn,F
- safety_code
- 22-26-36-36/37-16
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralEye Irrit. 2Flam. Liq. 2
Chemie und Industrie
Anwendungen
VerwendenZearalanone is a minor component of the zearalenone complex produced by several species of Fusarium. Like the more abundant analogues, zearalanone causes estrogenic effects in domestic livestock. Zearalanone is a metabolite of α-zearalanol, a commercially available growth promotant in animals, and is a useful standard for detection of zearanol-contaminated products and Fusarium-contaminated grains.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Anbieter57 Anbieter
成都乐美天医药科技有限公司17308096051 17308096051 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海哲研生物科技有限公司021-18017610038 18017610038 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
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