Ancymidol - for plant cell culture, ≥98%(HPLC) , CAS No.12771-68-5

CAS: 12771-68-5 Cat. No.: A120564 Fórmula: C₁₅H₁₆N₂O₂ Peso molecular: 256.3 Número CE: 235-814-7

GRADE & PURITY Suitable for plant cell culture, ≥98%(HPLC)

Synonyms

5-Pyrimidinemethanol, .alpha.-cyclopropyl-.alpha.-(4-methoxyphenyl)- | NCGC00164381-01 | A-Cyclopropyl-A(P-methoxyphenyl)-5-pyrimidine methanol | DNDI1255615 | A805739 | BDBM50024514 | EL-531;REDUCYMOL;THRITONE | EPA Pesticide Chemical Code 108601 | FT-06

Storage

Store at 2-8°C

Shipped In

Wet ice

Visão geral

Ancymidol is a pyrimidine-class plant cell endocrine disruptor plant growth regulator that interferes with gibberellin and cellulose biosynthesis.

Specifications

Sinónimos

5-Pyrimidinemethanol, .alpha.-cyclopropyl-.alpha.-(4-methoxyphenyl)- | NCGC00164381-01 | A-Cyclopropyl-A(P-methoxyphenyl)-5-pyrimidine methanol | DNDI1255615 | A805739 | BDBM50024514 | EL-531;REDUCYMOL;THRITONE | EPA Pesticide Chemical Code 108601 | FT-06

Especificações e pureza

for plant cell culture, ≥98%(HPLC)

Condições de armazenamento de armazenamento

Store at 2-8°C

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Grau

Adequado para cultura de células vegetais

Pureza

≥98%(HPLC)

Nomes e identificadores

Pubchem Sid

504753310

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504753310

Sorrisos canónicos

COC1=CC=C(C=C1)C(C2CC2)(C3=CN=CN=C3)O

IUPAC Name

cyclopropyl-(4-methoxyphenyl)-pyrimidin-5-ylmethanol

InChIKey

HUTDUHSNJYTCAR-UHFFFAOYSA-N

INCHI

1S/C15H16N2O2/c1-19-14-6-4-12(5-7-14)15(18,11-2-3-11)13-8-16-10-17-9-13/h4-11,18H,2-3H2,1H3

SMILES isoméricas

COC1=CC=C(C=C1)C(C2CC2)(C3=CN=CN=C3)O

WGK Alemanha

3

RTECS

UV9280000

Peso molecular

256.3

Reaxy-Rn

6212277

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6212277&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenol ethers
      • Subclass Anisoles

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenol ethers
• Subclass: Anisoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Anisoles
• Alternative Parents: Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Tertiary alcohols Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Aromatic alcohols
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Pyrimidine - Heteroaromatic compound - Tertiary alcohol - Ether - Azacycle - Organoheterocyclic compound - Alcohol - Aromatic alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
• External Descriptors: a small molecule

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

Alvos associados (humanos)

CYP19A1 Tclin Cytochrome P450 19A1 (6099 Activities)

Discover Target: CYP19A1

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

Alvos associados (não humanos)

Trypanosoma cruzi (99888 Activities)

Explore this target

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

Mecanismos de ação

Propriedades químicas e físicas

• Peso molecular: 256.300 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 256.121 Da
• Monoisotopic Mass: 256.121 Da
• Topological Polar Surface Area: 55.200 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 295.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1