(Q27097897)

Methyl vanillate (English)

19 October 2016

chemical formula

C₉H₁₀O₄

1 reference

Methyl vanillate (English)

20 November 2016

canonical SMILES

COC1=C(C=CC(=C1)C(=O)OC)O

1 reference

Methyl vanillate (English)

20 November 2016

melting point

64.0 degree Celsius

1 reference

Jean-Claude Bradley Open Melting Point Dataset

found in taxon

Securidaca longepedunculata

1 reference

Gas chromatographic/mass spectrometric investigation of the volatile main components from roots ofSecuridaca longipedunculata

Anthemis auriculata

2 references

Linear Sesquiterpene Lactones fromAnthemisauriculataand Their Antibacterial Activity

Linear Sesquiterpene Lactones fromAnthemis auriculataand Their Antimicrobial Activity

Aristolochia foveolata

3 references

Sodium aristolochate derivatives from leaves of Aristolochia foveolata

Constituents from the stems of Aristolochia manshuriensis

The constituents of the root and stem of Aristolochia heterophylla Hemsl

Aristolochia heterophylla

2 references

The constituents of the root and stem of Aristolochia heterophylla Hemsl

Constituents from the stems of Aristolochia manshuriensis

Aristolochia manshuriensis

2 references

Constituents from the stems of Aristolochia manshuriensis

The constituents of the root and stem of Aristolochia heterophylla Hemsl

Begonia nantoensis

2 references

Cytotoxic and anti-HIV principles from the rhizomes of Begonia nantoensis

Cytotoxic and anti-HIV Principles from the Rhizomes of Begonia nantoensis.

Hibiscus taiwanensis

2 references

Constituents from the stems of Hibiscus taiwanensis.

Constituents from the Stems of Hibiscus taiwanensis.

Melicope semecarpifolia

1 reference

Quinoline alkaloids and other constituents of Melicope semecarpifolia with antiplatelet aggregation activity.

Phyllanthus oligospermus

1 reference

Cytotoxic arylnaphthalene lignans from Phyllanthus oligospermus

Rhinacanthus nasutus

2 references

Rhinacanthin-Q, a naphthoquinone from Rhinacanthus nasutus and its biological activity

Naphthoquinone esters from the root of Rhinacanthus nasutus

Taraxacum formosanum

1 reference

Chemical constituents from roots of Taraxacum formosanum

Annona cherimola

3 references

Cheritamine, A NewN-Fatty Acyl Tryptamine and Other Constituents from the Stems ofAnnona cherimola

Annocherine C, A New C-α Hydroxy Benzylisoquinoline and Other Constituents from the Leaves ofAnnona Cherimola

Annocherine C, A New C-α Hydroxy Benzylisoquinoline and Other Constituents from the Leaves ofAnnona Cherimola

Aristolochia elegans

2 references

The alkaloids and other constituents from the root and stem of Aristolochia elegans

Constituents from the leaves of Aristolochia elegans

Aristolochia kankauensis

1 reference

Aristolochic acids, aristolactam alkaloids and amides from Aristolochia kankauensis

Aristolochia zollingeriana

1 reference

Aristolochic acids, aristolactam alkaloids and amides from Aristolochia kankauensis

Crocus sativus

1 reference

Antityrosinase principles and constituents of the petals of Crocus sativus

Houttuynia cordata

1 reference

The constituents and their bioactivities of Houttuynia cordata

Hovenia dulcis

1 reference

Neuroprotective and free radical scavenging activities of phenolic compounds from Hovenia dulcis

Piptostigma fugax

1 reference

Aporphinoid alkaloids and terpenoids from Piptostigma fugax

Tamarix aphylla

1 reference

Antimicrobial Activity and Phytochemical Constituents of Leaf Extracts of Cassia auriculata

Tetragonotheca repanda

1 reference

Melampolides from Tetragonotheca species

Acer rubrum

1 reference

New maplexins F–I and phenolic glycosides from red maple (Acer rubrum) bark

Cestrum parqui

1 reference

Low molecular weight phenols from the bioactive aqueous fraction of Cestrum parqui

Fibraurea tinctoria

1 reference

Anti-inflammatory activities of furanoditerpenoids and other constituents from Fibraurea tinctoria

Liriodendron tulipifera

1 reference

Chemical constituents from the stems of Liriodendron tulipifera

Litsea hypophaea

1 reference

Secondary metabolites from the roots of Litsea hypophaea and their antitubercular activity

Spiraea formosa

1 reference

New neolignans from Spiraea formosana

Tetradium glabrifolium

1 reference

The heartwood constituents of Tetradium glabrifolium

Trichocolea tomentella

1 reference

Aromatic esters and terpenoids of the liverworts in the genera Trichocolea, Neotrichocolea and Trichocoleopsis

Picea abies

1 reference

Analysis of chemical changes in Picea abies wood decayed by different Streptomyces strains showing evidence for biopulping procedures

Taraxacum mongolicum

1 reference

Chemical constituents from roots of Taraxacum formosanum

Aristolochia littoralis

2 references

Constituents from the leaves of Aristolochia elegans

The alkaloids and other constituents from the root and stem of Aristolochia elegans

Aristolochia kaempferi

4 references

Constituents from the stems of Aristolochia manshuriensis

The constituents of the root and stem of Aristolochia heterophylla Hemsl

Constituents of the Leaves of Aristolochia kaempferi.

Constituents from the stem and root of Aristolochia kaempferi

Identifiers

InChI

InChI=1S/C9H10O4/c1-12-8-5-6(9(11)13-2)3-4-7(8)10/h3-5,10H,1-2H3

1 reference

Methyl vanillate (English)

BVWTXUYLKBHMOX-UHFFFAOYSA-N

20 November 2016

InChIKey

2 references

Methyl vanillate (English)

20 November 2016

ChEBI release 2020-09-01

CAS Registry Number

3943-74-6

2 references

Global Substance Registration System

methyl vanillate (English)

BVWTXUYLKBHMOX-UHFFFAOYSA-N

20 November 2016

InChIKey

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=3943-74-6

1 reference

Methyl vanillate (English)

20 November 2016

1 reference

Methyl vanillate (English)

20 November 2016

Reaxys registry number

1369113

1 reference

methyl vanillate (English)

19 October 2016

ChEBI ID

46477

mapping relation type

1 reference

METHYL VANILLATE (English)

20 November 2016

1 reference

MSBNK-Fac_Eng_Univ_Tokyo-JP011441

METHYL VANILLATE (English)

20 November 2016

1 reference

MassBank accession ID

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP004564

0 references

SPLASH

splash10-0ue9-0900000000-c2808da990a74bab5038

0 references

DSSTox substance ID

DTXSID5074345

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

0 references

0 references

223-525-9

1 reference

Global Substance Registration System

methyl vanillate (English)

ECHA Substance Infocard ID

20 November 2016

100.021.388

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.021.388

27 December 2018

AICS Chemical ID (BEING DELETED)

Methyl vanillate (English)

quotation

CAS no.: 3943-74-6 (English)

FL number

09.799

1 reference

quotation

CAS no.: 3943-74-6 (English)

23 January 2021

09.799

1 reference

28 December 2019

METHYL VANILLATE (English)

quotation

CAS no.: 3943-74-6 (English)

0 references

1 reference

VANILLATE (English)

Human Metabolome Database ID

20 November 2016

HMDB0240266

1 reference

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00030768

1 reference

based on heuristic

inferred from InChIKey

1 reference

Global Substance Registration System

methyl vanillate (English)

20 November 2016

0 references

0 references

1 reference

1WB6 (English)

19 October 2016

1 reference

2YE3 (English)