(Q105113976)

English

Bistetradecanoic acid [(2S,3S)-2,3-bis(3-methoxy-4-hydroxybenzyl)-1,4-butanediyl]

chemical compound

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instance of

type of chemical entity

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subclass of

[2,3-Bis[(4-hydroxy-3-methoxyphenyl)methyl]-4-tetradecanoyloxybutyl] tetradecanoate

1 reference

based on heuristic

inferred from SMILES

mass

782.569669456 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₈H₇₈O₈

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canonical SMILES

O=C(OCC(CC1=CC=C(O)C(OC)=C1)C(COC(=O)CCCCCCCCCCCCC)CC2=CC=C(O)C(OC)=C2)CCCCCCCCCCCCC

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isomeric SMILES

CCCCCCCCCCCCCC(=O)OC[C@@H](Cc1ccc(O)c(OC)c1)[C@@H](COC(=O)CCCCCCCCCCCCC)Cc1ccc(O)c(OC)c1

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found in taxon

Homalolepis floribunda

1 reference

stated in

Isolation of secoisolariciresinol diesters from stems of Simaba cuneata

Identifiers

InChI

InChI=1S/C48H78O8/c1-5-7-9-11-13-15-17-19-21-23-25-27-47(51)55-37-41(33-39-29-31-43(49)45(35-39)53-3)42(34-40-30-32-44(50)46(36-40)54-4)38-56-48(52)28-26-24-22-20-18-16-14-12-10-8-6-2/h29-32,35-36,41-42,49-50H,5-28,33-34,37-38H2,1-4H3/t41-,42-/m1/s1

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InChIKey

IJKINCWERMSOSH-NCRNUEESSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IJKINCWERMSOSH-NCRNUEESSA-N

1 reference

(Q105113976)

Bistetradecanoic acid [(2S,3S)-2,3-bis(3-methoxy-4-hydroxybenzyl)-1,4-butanediyl]

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