(Q105193558)

English

(2S,3S,3aR)-5-methoxy-3-methyl-3a-prop-2-enyl-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran-6-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

5-methoxy-3-methyl-3a-(prop-2-en-1-yl)-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran-6-one

1 reference

based on heuristic

inferred from SMILES

mass

386.172938552 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2R,3S,3aS)-5-methoxy-3-methyl-3a-prop-2-enyl-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran-6-one

1 reference

based on heuristic

inferred from InChI

(2S,3S,3aS)-5-methoxy-3-methyl-3a-prop-2-enyl-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran-6-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₆O₆

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canonical SMILES

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

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isomeric SMILES

C=CC[C@@]12C=C(OC)C(=O)C=C1O[C@H](c1cc(OC)c(OC)c(OC)c1)[C@H]2C

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found in taxon

Nectandra

1 reference

stated in

Neolignans from a Nectandra species

Identifiers

InChI

InChI=1S/C22H26O6/c1-7-8-22-12-18(26-5)15(23)11-19(22)28-20(13(22)2)14-9-16(24-3)21(27-6)17(10-14)25-4/h7,9-13,20H,1,8H2,2-6H3/t13-,20+,22+/m1/s1

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InChIKey

OKICALHDZHJOLZ-XOJPMGEXSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OKICALHDZHJOLZ-XOJPMGEXSA-N

1 reference

(Q105193558)

(2S,3S,3aR)-5-methoxy-3-methyl-3a-prop-2-enyl-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran-6-one

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Identifiers

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