(Q105217773)

English

Diacarnoxide A

group of stereoisomers with the chemical formula C₂₅H₄₄O₄

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

408.323959888 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₄₄O₄

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canonical SMILES

O=C(OC)C(C)C1OOC(C)(CCCC(C)CCC2C(=C)CCCC2(C)C)CC1

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isomeric SMILES

C=C1CCCC(C)(C)C1CCC(C)CCC[C@@]1(C)CC[C@H]([C@H](C)C(=O)OC)OO1

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Identifiers

InChI

InChI=1S/C25H44O4/c1-18(12-13-21-19(2)11-9-15-24(21,4)5)10-8-16-25(6)17-14-22(28-29-25)20(3)23(26)27-7/h18,20-22H,2,8-17H2,1,3-7H3/t18?,20-,21?,22+,25-/m0/s1

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InChIKey

QBFWTWXSXJFPRL-YDXGDARJSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QBFWTWXSXJFPRL-YDXGDARJSA-N

1 reference

(Q105217773)

Diacarnoxide A

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Identifiers

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