(Q104987132)

English

NCGC00384573-01_C24H28O11_2-Propenoic acid, 3-(4-hydroxyphenyl)-, [(1S,4aR,5S,7aS)-1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-5-hydroxycyclopenta[c]pyran-7-yl]methyl ester, (2E)-

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[5-Hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl 3-(4-hydroxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

492.163161716 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1S,4aR,5S,7aR)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

10-(Z)-p-Coumaroylaucubin

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₄H₂₈O₁₁

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canonical SMILES

O=C(OCC1=CC(O)C2C=COC(OC3OC(CO)C(O)C(O)C3O)C12)C=CC4=CC=C(O)C=C4

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isomeric SMILES

O=C(/C=C/c1ccc(O)cc1)OCC1=C[C@@H](O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12

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found in taxon

Cordylanthus wrightii

1 reference

stated in

C-8 Epimeric iridoid glycosides of Cordylanthus (scrophulariaceae) species

Penstemon acuminatus

1 reference

stated in

Iridoids and other glucosides from Penstemon acuminatus

Utricularia vulgaris

1 reference

stated in

Iridoid glucosides from Utricularia australis and Pinguicula vulgaris (lentibulariaceae)

Utricularia australis

1 reference

stated in

Iridoid glucosides from Utricularia australis and Pinguicula vulgaris (lentibulariaceae)

Lamium album

1 reference

stated in

Lamiridosins, hepatitis C virus entry inhibitors from Lamium album.

Identifiers

InChI

InChI=1S/C24H28O11/c25-10-17-20(29)21(30)22(31)24(34-17)35-23-19-13(9-16(27)15(19)7-8-32-23)11-33-18(28)6-3-12-1-4-14(26)5-2-12/h1-9,15-17,19-27,29-31H,10-11H2/b6-3+/t15-,16+,17+,19+,20+,21-,22+,23-,24-/m0/s1

0 references

InChIKey

DQTBTFHCLVMGBP-WXUDOLSOSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DQTBTFHCLVMGBP-WXUDOLSOSA-N

1 reference

(Q104987132)

NCGC00384573-01_C24H28O11_2-Propenoic acid, 3-(4-hydroxyphenyl)-, [(1S,4aR,5S,7aS)-1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-5-hydroxycyclopenta[c]pyran-7-yl]methyl ester, (2E)-

Statements

Identifiers

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