(Q105136480)

English

3-[(2E,6R,7R)-6,7-dihydroxy-3,7,11-trimethyldodeca-2,10-dienyl]-4-hydroxybenzoic acid

chemical compound

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instance of

type of chemical entity

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subclass of

3-[(2E)-6,7-dihydroxy-3,7,11-trimethyldodeca-2,10-dien-1-yl]-4-hydroxybenzoic acid

1 reference

based on heuristic

inferred from SMILES

mass

376.224974124 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₂O₅

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canonical SMILES

O=C(O)C1=CC=C(O)C(=C1)CC=C(C)CCC(O)C(O)(C)CCC=C(C)C

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isomeric SMILES

CC(C)=CCC[C@@](C)(O)[C@H](O)CC/C(C)=C/Cc1cc(C(=O)O)ccc1O

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found in taxon

Ferula kuhistanica

1 reference

stated in

Prenylated benzoic acid derivatives from Ferula kuhistanica

Identifiers

InChI

InChI=1S/C22H32O5/c1-15(2)6-5-13-22(4,27)20(24)12-8-16(3)7-9-17-14-18(21(25)26)10-11-19(17)23/h6-7,10-11,14,20,23-24,27H,5,8-9,12-13H2,1-4H3,(H,25,26)/b16-7+/t20-,22-/m1/s1

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InChIKey

JXAFVRIAOQJYNY-KQCYKBMJSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JXAFVRIAOQJYNY-KQCYKBMJSA-N

(Q105136480)

3-[(2E,6R,7R)-6,7-dihydroxy-3,7,11-trimethyldodeca-2,10-dienyl]-4-hydroxybenzoic acid

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