(Q105026514)

English

methyl (1S,3R,4S,5R)-1,3,5-trihydroxy-4-{[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylate

chemical compound

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No description defined

Statements

type of chemical entity

0 references

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

1 reference

based on heuristic

inferred from SMILES

352.1158176 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

methyl (1R,3R,4R,5R)-1,3,5-trihydroxy-4-{[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₀O₈

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canonical SMILES

O=C(OC1C(O)CC(O)(C(=O)OC)CC1O)C=CC2=CC=C(O)C=C2

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isomeric SMILES

COC(=O)[C@]1(O)C[C@@H](O)[C@@H](OC(=O)/C=C/c2ccc(O)cc2)[C@H](O)C1

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Haplopteris anguste-elongata

1 reference

Constituents of Vittaria anguste-elongata and their biological activities

Spuriopimpinella calycina

1 reference

Quinic acid derivatives from Pimpinella brachycarpa exert anti-neuroinflammatory activity in lipopolysaccharide-induced microglia

Spuriopimpinella brachycarpa

1 reference

Quinic acid derivatives from Pimpinella brachycarpa exert anti-neuroinflammatory activity in lipopolysaccharide-induced microglia

Identifiers

InChI=1S/C17H20O8/c1-24-16(22)17(23)8-12(19)15(13(20)9-17)25-14(21)7-4-10-2-5-11(18)6-3-10/h2-7,12-13,15,18-20,23H,8-9H2,1H3/b7-4+/t12-,13-,15-,17+/m1/s1

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HDSDPFJFNJWIDZ-YKTSSCPESA-N

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DSSTox substance ID

DTXSID301346436

1 reference

matched by identifier from

HDSDPFJFNJWIDZ-YKTSSCPESA-N

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