santamarine (Q27089375)

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chemical compound

(3aS,5aR,6R,9aS,9bS)-6-hydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one
(3aS)-2,3,3abeta,4,5,5a,6,7,9abeta,9balpha-Decahydro-6alpha-hydroxy-5aalpha,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2-one
(+)-santamarine
Balchanin

Language	Label	Description	Also known as
English	santamarine	chemical compound	(3aS,5aR,6R,9aS,9bS)-6-hydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one (3aS)-2,3,3abeta,4,5,5a,6,7,9abeta,9balpha-Decahydro-6alpha-hydroxy-5aalpha,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2-one (+)-santamarine Balchanin

Statements

type of chemical entity

0 references

eudesmane sesquiterpenoid

0 references

248.141245±0 dalton

1 reference

language of work or name

Santamarine (English)

4 October 2016

stereoisomer of

(1R)-alpha-Methylene-1alpha,5beta-dihydroxy-4abeta,8-dimethyl-1,2,3,4,4a,5,6,8aalpha-octahydronaphthalene-2alpha-acetic acid 2,1-lactone

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aR,5aR,6S,9aS,9bS)-6-hydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aR,5aR,6R,9aS,9bS)-6-hydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aS,5aS,6S,9aS,9bS)-6-hydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aR,5aS,6S,9aR,9bR)-6-hydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one

1 reference

based on heuristic

inferred from InChI

(3aS,5aR,6R,9aS,9bR)-6-hydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₀O₃

1 reference

language of work or name

Santamarine (English)

18 November 2016

canonical SMILES

CC1=CCC(C2(C1C3C(CC2)C(=C)C(=O)O3)C)O

1 reference

language of work or name

Santamarine (English)

18 November 2016

isomeric SMILES

CC1=CC[C@H]([C@]2([C@H]1[C@@H]3[C@@H](CC2)C(=C)C(=O)O3)C)O

1 reference

language of work or name

Santamarine (English)

18 November 2016

Tanacetum parthenium

3 references

Anxiolytic- and antidepressant-like effects of an aqueous extract of Tanacetum parthenium L. Schultz-Bip (Asteraceae) in mice

3,4-β-Epoxy-8-deoxycumambrin B, A sesquiterpene lactone from Tanacetum parthenium

Comparative study of Tanacetum species growing in Bulgaria.

Achillea pratensis

3 references

Qualitative and quantitative determination of sesquiterpenoids in Achillea species by reversed-phase high-performance liquid chromatography, mass-spectrometry and thin-layer chromatography

Eudesmanolides from Achillea pratensis

Eudesmanolides from Achillea pratensis

Artemisia ludoviciana

3 references

Sesquiterpene lactones of Artemisia mexicana var. Angustifolia

Sesquiterpene lactones and flavonoids from Artemisia ludoviciana ssp. mexicana

Sesquiterpene lactones and flavonoids from Artemisia ludoviciana ssp. mexicana

Echinops pappii

1 reference

Polyacetylenic thiophenes and terpenoids from the roots of Echinops pappii

Guizotia scabra

1 reference

Sesquiterpene lactones and other constituents from Siegesbeckia orientalis and Guizotia scabra

Achillea micrantha

2 references

Sesquiterpene lactones from Achillea micrantha

Sesquiterpene lactones from Achillea micrantha

Inulanthera dregeana

1 reference

Chemotaxonomy of Athanasia and related genera

Artemisia rutifolia

1 reference

Sesquiterpenes from Artemisia rutifolia

Artemisia umbelliformis

1 reference

Genepolide, a sesterpene gamma-lactone with a novel carbon skeleton from mountain wormwood (Artemisia umbelliformis).

Artemisia verlotorum

1 reference

Sesquiterpene lactones from Artemisia species

Tanacetum praeteritum

2 references

Sesquiterpene lactones from Tanacetum praeteritum

Cytotoxic and antibacterial activities of sesquiterpene lactones isolated from Tanacetum praeteritum subsp. praeteritum

Tanacetum argenteum

1 reference

Sesquiterpenoids from Tanacetum argenteum subsp. canum var. canum

Symphyotrichum subulatum var. squamatum

1 reference

PHYTOCHEMICAL STUDIES ON ASTER SQUAMATUS L. PART II: Sesquiterpene Lactones, Triterpenes and Sterols Present in the Flowers

Artemisia xanthochloa

1 reference

Seco-guaianolides and other constituents from Artemisia species

Liabum solidagineum

1 reference

Sesquiterpenes from Liabum floribundum

Cyathocline purpurea

2 references

A germacranolide from cyathocline lutea

A germacranolide from Cyathocline lutea

Argyranthemum adauctum

1 reference

Sesquiterpenes and acetylenes from Argyranthemum adauctum ssp. jacobaeifolium

Eremanthus erythropappus

1 reference

Selective Extraction of α-Methylene-γ-Lactones. Reinvestigation of Vanillosmopsis erythropappa

Centaurea uniflora

1 reference

Sesquiterpene lactones from Centaurea uniflora subsp. Nervosa

Artemisia hispanica

1 reference

Sesquiterpene lactones from Artemisia hispanica

Rudbeckia subtomentosa

1 reference

Sesquiterpene lactones and lignanes from Rudbeckia species

Centaurea ornata

1 reference

Guaianolides and eudesmanolides from Centaurea ornata

Stevia chamaedrys

1 reference

Guaianolides and other constituents from Stevia species

Centaurea acaulis

1 reference

A new guaianolide and other sesquiterpene lactones from Centaurea acaulis L. (Asteraceae)

Anthemis macedonica

1 reference

Sesquiterpene lactones as chemotaxonomic markers in genus Anthemis

Eriocephalus kingesii

1 reference

Sesquiterpene lactones and other constituents from Eriocephalus species

Eupatorium capillifolium

1 reference

Flavonoids and sesquiterpenoids, constituents from Eupatorium capillifolium, found in a screening study guided by cell growth inhibitory activity

Inulanthera calva

1 reference

Chemotaxonomy of Athanasia and related genera

Podachaenium eminens

2 references

Inhibition of the transcription factor NF-kappa B by sesquiterpene lactones from Podachaenium eminens

Inhibition of the transcription factor NF-kappa B by sesquiterpene lactones from Podachaenium eminens

Ambrosia confertiflora

1 reference

Sesquiterpene lactones from Ambrosia confertiflora (Compositae)

Chamaemelum fuscatum

1 reference

Eudesmanolides from Chamaemelum fuscatum

Lactuca floridana

1 reference

Biosynthetic studies of lactucin derivatives in hairy root cultures of lactuca floridana

Magnolia kachirachirai

1 reference

Secondary Metabolites from Magnolia kachirachirai

Artemisia verlotiorum

1 reference

Sesquiterpene lactones from Artemisia species

Dolomiaea costus

3 references

Cytotoxic sesquiterpene lactones from the root of Saussurea lappa

Inhibitory effect of sesquiterpene lactones from Saussurea lappa on tumor necrosis factor-alpha production in murine macrophage-like cells

Santamarin, a sesquiterpene lactone isolated from Saussurea lappa, represses LPS-induced inflammatory responses via expression of heme oxygenase-1 in murine macrophage cells

Magnolia grandiflora

1 reference

Cytotoxic sesquiterpenoids from the leaves of Magnolia grandiflora

Artemisia argyi

1 reference

Sesquiterpene Lactones from Artemisia argyi: Absolute Configuration and Immunosuppressant Activity

1 reference

New sesquiterpene lactones from Laurus nobilis leaves as inhibitors of nitric oxide production

Achillea millefolium

2 references

Qualitative and quantitative determination of sesquiterpenoids in Achillea species by reversed-phase high-performance liquid chromatography, mass-spectrometry and thin-layer chromatography

Eudesmanolides from Achillea pratensis

Artemisia biennis

1 reference

Sesquiterpene lactones from Artemisia hispanica

Artemisia aethiopica

1 reference

Sesquiterpene lactones from Artemisia hispanica

has characteristic

1 reference

Identifiers

InChI=1S/C15H20O3/c1-8-4-5-11(16)15(3)7-6-10-9(2)14(17)18-13(10)12(8)15/h4,10-13,16H,2,5-7H2,1,3H3/t10-,11+,12+,13-,15-/m0/s1

1 reference

language of work or name

Santamarine (English)

18 November 2016

PLSSEPIRACGCBO-PFFFPCNUSA-N

2 references

language of work or name

Santamarine (English)

18 November 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

Global Substance Registration System

language of work or name

santamarine (English)

18 November 2016

CAS Common Chemistry

6 April 2021

https://commonchemistry.cas.org/detail?cas_rn=4290-13-5

PLSSEPIRACGCBO-PFFFPCNUSA-N

1 reference

language of work or name

(3aS,5aR,6R,9aS,9bS)-6-Hydroxy-5a,9-dimethyl-3-methylene-3a,4,5,5a,6,7,9a,9b-octahydronaphtho[1,2-b]furan-2(3H)-one (English)

18 November 2016

2 references

language of work or name

Santamarine (English)

18 November 2016

matched by identifier from

PLSSEPIRACGCBO-PFFFPCNUSA-N

Reaxys registry number

1287299

1 reference

language of work or name

santamarin (English)

4 October 2016

mapping relation type

2 references

language of work or name

SANTAMARIN (English)

18 November 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C15H20O3/c1-8-4-5-11(16)15(3)7-6-10-9(2)14(17)18-13(10)12(8)15/h4,10-13,16H,2,5-7H2,1,3H3/t10-,11+,12+,13-,15-/m0/s1

1 reference

language of work or name

SANTAMARIN (English)

18 November 2016

UniChem compound ID

1 reference

DSSTox substance ID

1 reference

matched by identifier from

PLSSEPIRACGCBO-PFFFPCNUSA-N

DSSTOX compound identifier

DTXCID401340548

0 references

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

PLSSEPIRACGCBO-PFFFPCNUSA-N

1 reference

language of work or name

santamarin (English)

4 October 2016

2 references

Global Substance Registration System

language of work or name

santamarine (English)

18 November 2016

matched by identifier from

PLSSEPIRACGCBO-PFFFPCNUSA-N

1 reference

language of work or name

santamarin (English)

4 October 2016

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

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