(Q105380971)

English

Pinetoric acid II

group of stereoisomers with the chemical formula C₂₃H₃₂O₄

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

372.230059504 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₃₂O₄

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canonical SMILES

O=C(O)CC(C1=C2OC(C)C(C)CC2=CC=3C=CC(OC31)(C)C)CCCC

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isomeric SMILES

CCCCC(CC(=O)O)c1c2c(cc3c1O[C@H](C)[C@H](C)C3)C=CC(C)(C)O2

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found in taxon

Calophyllum pinetorum

1 reference

stated in

Constituents of the Cuban endemic species Calophyllum pinetorum

Identifiers

InChI

InChI=1S/C23H32O4/c1-6-7-8-16(13-19(24)25)20-21-18(11-14(2)15(3)26-21)12-17-9-10-23(4,5)27-22(17)20/h9-10,12,14-16H,6-8,11,13H2,1-5H3,(H,24,25)/t14-,15-,16?/m1/s1

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InChIKey

ZPJYEOFZEARSTL-YGFGXBMJSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ZPJYEOFZEARSTL-YGFGXBMJSA-N

1 reference

(Q105380971)

Pinetoric acid II

Statements

Identifiers

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