(Q105257029)

English

2-Epi-3a-epiburchellin

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(3aR)-2-(1,3-benzodioxol-5-yl)-5-methoxy-3-methyl-3a-prop-2-enyl-2,3-dihydro-1-benzofuran-6-one

1 reference

based on heuristic

inferred from SMILES

mass

340.13107374 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S,3R,3aS)-2-(1,3-benzodioxol-5-yl)-5-methoxy-3-methyl-3a-prop-2-enyl-2,3-dihydro-1-benzofuran-6-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2S,3S,3aR)-2-(2H-1,3-benzodioxol-5-yl)-5-methoxy-3-methyl-3a-(prop-2-en-1-yl)-3,3a-dihydro-1-benzofuran-6(2H)-one

2 references

based on heuristic

inferred from InChIKey

1 reference

(2R)-2beta-(1,3-Benzodioxole-5-yl)-3beta-methyl-3a-allyl-5-methoxy-2,3,3abeta,6-tetrahydrobenzofuran-6-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₀O₅

0 references

canonical SMILES

O=C1C=C2OC(C3=CC=C4OCOC4=C3)C(C)C2(C=C1OC)CC=C

0 references

isomeric SMILES

C=CC[C@]12C=C(OC)C(=O)C=C1O[C@@H](c1ccc3c(c1)OCO3)[C@H]2C

0 references

found in taxon

Aniba

1 reference

stated in

Neolignans, styrylpyrones and flavonoids from an Aniba species

Iryanthera ulei

2 references

stated in

Diarylpropanes from Iryanthera ulei

stated in

Diarylpropanes from Iryanthera ulei

Nectandra grandiflora

1 reference

stated in

A new neolignan and antioxidant phenols from Nectandra grandiflora

Magnolia denudata

1 reference

stated in

Bicyclo[3.2.1]octane and 6-oxabicyclo[3.2.2]nonane type neolignans from Magnolia denudata

Piper hymenophyllum

1 reference

stated in

Benzofuranoid Neolignans from Piper wightii Miq..

Piper wightii

1 reference

stated in

Benzofuranoid Neolignans from Piper wightii Miq..

Iryanthera hostmannii

1 reference

stated in

Diarylpropanes from Iryanthera ulei

Identifiers

InChI

InChI=1S/C20H20O5/c1-4-7-20-10-17(22-3)14(21)9-18(20)25-19(12(20)2)13-5-6-15-16(8-13)24-11-23-15/h4-6,8-10,12,19H,1,7,11H2,2-3H3/t12-,19-,20-/m1/s1

0 references

InChIKey

SOLJFAQVSWXZEQ-TVNIXMEMSA-N

0 references

CAS Registry Number

57457-99-5

1 reference

stated in

CAS (formerly Chemical Abstracts Service)

25 January 2022

2 references

26 December 2021

matched by identifier from

InChIKey

SOLJFAQVSWXZEQ-TVNIXMEMSA-N

1 reference

1 reference

matched by identifier from

InChIKey

SOLJFAQVSWXZEQ-TVNIXMEMSA-N

(Q105257029)

2-Epi-3a-epiburchellin

Statements

Identifiers

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