(Q82997211)

English

2,8-Bis(4-hydroxyphenyl)-3,4-dihydro-2H,8H,14H-8,14-methano-1,7,9-trioxabenzo[6,7]cycloocta[1,2-a]naphthalene-3,5,11,13,15-pentol

group of stereoisomers with the chemical formula C₃₀H₂₄O₁₀

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

544.1369469679998 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₀H₂₄O₁₀

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based on heuristic

inferred from SMILES

canonical SMILES

Oc1ccc(C2Oc3c(c(O)cc4c3C3c5c(O)cc(O)cc5OC(c5ccc(O)cc5)(O4)C3O)CC2O)cc1

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

Oc1ccc([C@H]2Oc3c(c(O)cc4c3[C@@H]3c5c(O)cc(O)cc5O[C@](c5ccc(O)cc5)(O4)C3O)C[C@H]2O)cc1

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based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C30H24O10/c31-15-5-1-13(2-6-15)27-21(36)11-18-19(34)12-23-25(28(18)38-27)26-24-20(35)9-17(33)10-22(24)39-30(40-23,29(26)37)14-3-7-16(32)8-4-14/h1-10,12,21,26-27,29,31-37H,11H2/t21-,26+,27-,29?,30-/m1/s1

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InChIKey

LQRHGTVFFPMWCG-DFRNNGSQSA-N

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26 December 2021

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DSSTOX compound identifier

DTXCID601429805

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(Q82997211)

2,8-Bis(4-hydroxyphenyl)-3,4-dihydro-2H,8H,14H-8,14-methano-1,7,9-trioxabenzo[6,7]cycloocta[1,2-a]naphthalene-3,5,11,13,15-pentol

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