(Q104967845)

English

methyl (1R,3S,4S,5S)-1,3,4-trihydroxy-5-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyloxy]cyclohexane-1-carboxylate

chemical compound

In more languages

Statements

type of chemical entity

0 references

Methyl 1,3,4-trihydroxy-5-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyloxy]cyclohexane-1-carboxylate

1 reference

based on heuristic

inferred from SMILES

382.126382284 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Methyl 5-O-feruloylquinate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

Methyl 3-O-feruloylquinate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

methyl (1R,3R,4S,5R)-1,3,4-trihydroxy-5-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyloxy]cyclohexane-1-carboxylate

1 reference

based on heuristic

inferred from InChI

methyl (1R,3S,4S,5S)-1,3,4-trihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₈H₂₂O₉

0 references

canonical SMILES

O=C(OC1CC(O)(C(=O)OC)CC(O)C1O)C=CC2=CC=C(O)C(OC)=C2

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isomeric SMILES

COC(=O)[C@@]1(O)C[C@H](O)[C@H](O)[C@@H](OC(=O)C=Cc2ccc(O)c(OC)c2)C1

0 references

Lonicera bournei

1 reference

Studies on the hepatocyte protective activity and the structure-activity relationships of quinic acid and caffeic acid derivatives from the flower buds of Lonicera bournei

Identifiers

InChI=1S/C18H22O9/c1-25-13-7-10(3-5-11(13)19)4-6-15(21)27-14-9-18(24,17(23)26-2)8-12(20)16(14)22/h3-7,12,14,16,19-20,22,24H,8-9H2,1-2H3/t12-,14-,16-,18+/m0/s1

0 references

CPYDMLXRLHYXSV-WIRVQXDCSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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