(Q105149947)

English

[(9S,10S,11S)-10-hydroxy-3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-yl] 3-methylbut-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

chemical compound

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mass

514.220282668 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₄O₉

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canonical SMILES

O=C(OC1C2=CC=3OCOC3C(OC)=C2C=4C(OC)=C(OC)C(OC)=CC4CC(C)C1(O)C)C=C(C)C

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isomeric SMILES

COc1cc2c(c(OC)c1OC)-c1c(cc3c(c1OC)OCO3)[C@H](OC(=O)C=C(C)C)[C@@](C)(O)[C@@H](C)C2

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found in taxon

Schisandra arisanensis

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stated in

Oxygenated lignans from the fruits of Schisandra arisanensis.

stated in

Oxygenated lignans from the fruits of Schisandra arisanensis.

Schisandra chinensis

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stated in

Analysis of lignan constituents from Schisandra chinensis by liquid chromatography-electrospray mass spectrometry

stated in

Analysis of lignans in Schisandra chinensis and rat plasma by high-performance liquid chromatography diode-array detection, time-of-flight mass spectrometry and quadrupole ion trap mass spectrometry

stated in

Analysis of Schisandra chinensis and Schisandra sphenanthera

Schisandra neglecta

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stated in

Bioactive dibenzocyclooctadiene lignans from the stems of Schisandra neglecta

Identifiers

InChI

InChI=1S/C28H34O9/c1-14(2)9-20(29)37-27-17-12-19-24(36-13-35-19)26(34-8)22(17)21-16(10-15(3)28(27,4)30)11-18(31-5)23(32-6)25(21)33-7/h9,11-12,15,27,30H,10,13H2,1-8H3/t15-,27-,28-/m0/s1

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InChIKey

LCQKYZXWCLBYHK-WIKKSFEZSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LCQKYZXWCLBYHK-WIKKSFEZSA-N

1 reference

(Q105149947)

[(9S,10S,11S)-10-hydroxy-3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-yl] 3-methylbut-2-enoate

Statements

Identifiers

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