isopimaric acid (Q4198762)

inferred from SMILES

chemical structure

Isopimaric acid.svg
512 × 495; 20 KB

0 references

mass

302.22458±0 dalton

1 reference

ISOPIMARIC ACID (English)

5 October 2016

2 references

inferred from InChIKey

(13S)-7,15-Pimaradiene-19-oic acid

1 reference

(1R,4aR,4bS,7S,10aS)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid

1 reference

7,15-Pimaradien-18-oic acid

1 reference

9beta-pimara-7,15-dien-19-oic acid

1 reference

chemical formula

C₂₀H₃₀O₂

1 reference

ISOPIMARIC ACID (English)

5 October 2016

canonical SMILES

CC1(CCC2C(=CCC3C2(CCCC3(C)C(=O)O)C)C1)C=C

1 reference

ISOPIMARIC ACID (English)

5 October 2016

isomeric SMILES

C[C@@]1(CC[C@H]2C(=CC[C@@H]3[C@@]2(CCC[C@@]3(C)C(=O)O)C)C1)C=C

1 reference

Some terpenoid components of the needles of the Siberian stone pine

ISOPIMARIC ACID (English)

5 October 2016

2 references

Chemical composition of the bark ofPinus sibirica

Pinus ponderosa

2 references

Resin acids of Pinus ponderosa needles

Minor components of ponderosa pine oleoresin

Pinus nigra

1 reference

Major resin acids of Pinus nigra needles

Larix kaempferi

1 reference

Terpenoids of the oleoresin ofLarix leptolepis

Pinus strobus

1 reference

Diterpene resin acids from the needle oleoresin of pinus strobus

Pinus pumila

1 reference

Terpenoids of the oleoresin of Pinus pumila

Pinus brutia var. pityusa

1 reference

Terpenoids of the oleoresins ofPinus pityusa andP. eldarica

Pinus brutia var. eldarica

1 reference

Terpenoids of the oleoresins ofPinus pityusa andP. eldarica

Podocarpus

1 reference

Terpenes of Podocarpus lambertius

Boesenbergia rotunda

1 reference

Anti-inflammatory cyclohexenyl chalcone derivatives in Boesenbergia pandurata

Chamaecyparis formosensis

1 reference

Terpenes and lignans from leaves of Chamaecyparis formosensis

Juniperus excelsa

1 reference

Diterpenes from the berries of Juniperus excelsa

Pinus taeda

1 reference

Diterpenes from pinus taeda

Salvia caespitosa

2 references

Cardioactive and antibacterial terpenoids from some Salvia species

A new antibacterial diterpene from the roots of Salvia caespitosa

Tetraclinis articulata

1 reference

Diterpenoids from Tetraclinis articulata that inhibit various human leukocyte functions

Juniperus

1 reference

Oxygenated Diterpenes and Other Constituents from Moroccan Juniperus phoenicea and Juniperus thurifera Var. africana

Cryptomeria japonica

2 references

Diterpenoids from leaves of Cryptomeria japonica

Anti-inflammatory constituents of topically applied crude drugs. II. Constituents and anti-inflammatory effect of Cryptomeria japonica D. Don

Calamus draco

1 reference

Diterpenoid resin acids of Daemonorops draco

Juniperus communis

2 references

Diterpene acids from Juniperus communis subsp. Hemisphaerica

New natural diterpene acids from Juniperus communis

Larix gmelinii var. gmelinii

4 references

Terpenoids of the oleoresin of the larch growing in Kamchatka

Chemical composition of the oleoresin of Larix dahurica

Extractive substances in the bark of Larix dahurica

Chemical composition of the oleoresin ofLarix kamtschatica

Larix gmelinii var. olgensis

1 reference

Terpenoids of the oleoresin ofLarix olgensis

Nepeta tuberosa

1 reference

Diterpenoids from Nepeta tuberosa subsp. reticulata

Picea obovata

3 references

Extractive substances of the bark of Picea obovata

Extractive substances of the bark ofPicea obovata

Extractive substances of the bark of Picea obovata

Pinus masoni

1 reference

Cancer chemopreventive activity of "rosin" constituents of Pinus spez. and their derivatives in two-stage mouse skin carcinogenesis test

Pinus merkusii

2 references

Variability in xylem resin composition amongst natural populations of indonesian Pinus merkusii

Toxic effects of some conifer resin acids and tea tree oil on human epithelial and fibroblast cells

Pinus pinaster

1 reference

Acid fraction evolution in wood extractives ofPinus pinaster ait

Pseudotsuga sinensis var. sinensis

1 reference

Terpenoids and flavonoids from Pseudotsuga wilsoniana

Salvia greggii

3 references

Diterpenoid from Salvia greggii

Diterpenoids from Salvia greggii

Diterpenoid from Salvia greggii

Salvia wiedemannii

2 references

Diterpenoids from Salvia wiedemannii

Diterpenoids from Salvia wiedemannii

Tillandsia brachycaulos

1 reference

Two New 24-Isopropenyl-lanostanoids from Tillandsia brachycaulos

Torreya nucifera

2 references

18-Oxoferruginol from the leaf of Torreya nucifera

Biflavonoids from Torreya nucifera displaying SARS-CoV 3CL(pro) inhibition

Homo sapiens

1 reference

The human saliva metabolome

Thuja occidentalis

1 reference

Bioactive constituents of Thuja occidentalis.

Abies spectabilis

1 reference

Systematic phytochemical investigation of Abies spectabilis.

Armillaria mellea

1 reference

Metabolites of the honey mushroom, Armillariamellea

Halocarpus bidwillii

1 reference

Diterpenes of Dacrydium bidwillii

Juniperus rigida

1 reference

Studies on the Resin Acid in the Fruits of Juniperus japonica

Juniperus thurifera

1 reference

Oxygenated diterpenes and other constituents from Moroccan Juniperus phoenicea and Juniperus thurifera var. africana.

Larix decidua

1 reference

In vitro anti-inflammatory activity of larch (Larix decidua L.) sawdust

Pinus resinosa

1 reference

THE HEARTWOOD EXTRACTIVES OF PINUS RESINOSA AIT•

Rhizoclonium hieroglyphicum

1 reference

Diterpenoids from the freshwater green algae Rhizoclonium hieroglyphicum with antibacterial activity.

Platycladus orientalis

4 references

15-Hydroxypinusolidic Acid, a New Diterpene from the Pericarp of Platycladus orientalis Franco

Chemical Constituents of the Pericarp ofPlatycladus orientalis

Terpenoids from the seed of platycladus orientalis

Identification and characterization of GABA(A) receptor modulatory diterpenes from Biota orientalis that decrease locomotor activity in mice.

Juniperus scopulorum

1 reference

Diterpenes from the berries of Juniperus excelsa

subject has role

ionophore

1 reference

InChI=1S/C20H30O2/c1-5-18(2)12-9-15-14(13-18)7-8-16-19(15,3)10-6-11-20(16,4)17(21)22/h5,7,15-16H,1,6,8-13H2,2-4H3,(H,21,22)/t15-,16+,18-,19+,20+/m0/s1

Medical Subject Headings

15 March 2018

0 references

Identifiers

InChI

1 reference

ISOPIMARIC ACID (English)

5 October 2016

2 references

ChemIDplus

Isopimaric acid (English)

http://chem.sis.nlm.nih.gov/chemidplus/rn/5835-26-7

15 April 2016

reference URL

ISOPIMARIC ACID (English)

5 October 2016

3 references

Isopimaric acid (English)

http://chem.sis.nlm.nih.gov/chemidplus/rn/5835-26-7

15 April 2016

reference URL

isopimaric acid (English)

5 October 2016

https://commonchemistry.cas.org/detail?cas_rn=5835-26-7

10 April 2021

1 reference

Isopimaric Acid (English)

5 October 2016

1 reference

ISOPIMARIC ACID (English)

5 October 2016

Reaxys registry number

2293612

1 reference

isopimaric acid (English)

5 October 2016

ChEBI ID

6039

mapping relation type

3 references

isopimaric acid (English)

5 October 2016

matched by identifier from

ChEBI release 2021-03-01

International Chemical Identifier

InChI

InChI=1S/C20H30O2/c1-5-18(2)12-9-15-14(13-18)7-8-16-19(15,3)10-6-11-20(16,4)17(21)22/h5,7,15-16H,1,6,8-13H2,2-4H3,(H,21,22)/t15-,16+,18-,19+,20+/m0/s1

1 reference

matched by identifier from

ISOPIMARIC ACID (English)

5 October 2016

2 references

inferred from InChIKey

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

1 reference

1 reference

DSSTOX compound identifier

DTXCID702233

0 references

EC number

635-236-9

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.163.144

27 December 2018

ECHA Substance Infocard ID

[No public or meaningful name is available] (English)

quotation

CAS no.: 5835-26-7 (English)

100.163.144

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.163.144

27 December 2018

[No public or meaningful name is available] (English)

quotation

CAS no.: 5835-26-7 (English)

MeSH descriptor ID

C115138

1 reference

Medical Subject Headings

MeSH descriptor ID

C115138

Human Metabolome Database ID

14 March 2018

HMDB0036811

2 references

matched by identifier from

inferred from InChIKey

1 reference

isopimaric acid (English)

5 October 2016

2 references

Isopimaric acid (English)

http://chem.sis.nlm.nih.gov/chemidplus/rn/5835-26-7

15 April 2016

reference URL

Global Substance Registration System

UNII

1E37K85HHK

ISOPIMARIC ACID (English)

5 October 2016

0 references

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

isopimaric acid (English)

5 October 2016

1 reference