(Q83012889)

English

11H,13H-Oxireno(d)pyrano(4',3':3,3a)isobenzofuro(5,4-f)(2)benzopyran-4,6,13(2H,5aH)-trione, decahydro-2,2,4a,8a-tetramethyl-8-(tetrahydro-3-furyl)-, stereoisomer

group of stereoisomers with the chemical formula C₂₆H₃₄O₈

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

474.2253680479999 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₆H₃₄O₈

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based on heuristic

inferred from SMILES

canonical SMILES

CC1(C)OC2CC(=O)OCC23C1CC(=O)C1(C)C3CCC2(C)C(C3CCOC3)OC(=O)C3OC321

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CC1(C)O[C@H]2CC(=O)OC[C@]23[C@H]2CC[C@@]4(C)[C@H](C5CCOC5)OC(=O)[C@H]5O[C@]54[C@]2(C)C(=O)C[C@@H]13

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based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C26H34O8/c1-22(2)15-9-16(27)24(4)14(25(15)12-31-18(28)10-17(25)33-22)5-7-23(3)19(13-6-8-30-11-13)32-21(29)20-26(23,24)34-20/h13-15,17,19-20H,5-12H2,1-4H3/t13?,14-,15-,17-,19-,20+,23-,24-,25+,26+/m0/s1

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InChIKey

FNYYTFCORGLHIJ-DTPIEBFASA-N

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CAS Registry Number

1062-07-3

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InChIKey

FNYYTFCORGLHIJ-DTPIEBFASA-N

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=1062-07-3

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26 December 2021

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DSSTOX compound identifier

DTXCID9070032

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(Q83012889)

11H,13H-Oxireno(d)pyrano(4',3':3,3a)isobenzofuro(5,4-f)(2)benzopyran-4,6,13(2H,5aH)-trione, decahydro-2,2,4a,8a-tetramethyl-8-(tetrahydro-3-furyl)-, stereoisomer

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Identifiers

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