(Q82230150)

English

NSC135032

group of stereoisomers with the chemical formula C₂₆H₃₄O₆

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

442.23553880799994 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₃₄O₆

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based on heuristic

inferred from SMILES

canonical SMILES

CC12OC3CC(O1)C1(C)C4CCC5(C)C(c6ccc(=O)oc6)CCC5(O)C4CCC1(C3)O2

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CC12O[C@H]3C[C@@H](O1)[C@]1(C)[C@H]4CC[C@]5(C)[C@@H](c6ccc(=O)oc6)CC[C@]5(O)[C@@H]4CC[C@@]1(C3)O2

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based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C26H34O6/c1-22-9-6-18-19(26(22,28)11-8-17(22)15-4-5-21(27)29-14-15)7-10-25-13-16-12-20(23(18,25)2)31-24(3,30-16)32-25/h4-5,14,16-20,28H,6-13H2,1-3H3/t16-,17+,18-,19+,20+,22+,23-,24?,25-,26-/m0/s1

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InChIKey

BVIKZDOSWIBQSC-SWLXASJHSA-N

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1 reference

26 December 2021

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DSSTOX compound identifier

DTXCID90370067

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NSC number

135032

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(Q82230150)

NSC135032

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Identifiers

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