(Q409569)

English

nivalenol (stereochemistry not fully defined)

chemical compound

In more languages

Statements

group of stereoisomers

0 references

(2R,3S,7R,9R,10R,11S)-3,10,11-trihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-one

1 reference

based on heuristic

inferred from SMILES

312.120903 dalton

1 reference

language of work or name

NIVALENOL (English)

21 September 2016

chemical formula

C₁₅H₂₀O₇

1 reference

language of work or name

NIVALENOL (English)

21 September 2016

canonical SMILES

CC1=CC2C(C(C1=O)O)(C3(C(C(C(C34CO4)O2)O)O)C)CO

1 reference

language of work or name

NIVALENOL (English)

21 September 2016

isomeric SMILES

CC1=C[C@@H]2[C@]([C@@H](C1=O)O)([C@]3([C@@H]([C@H]([C@H](C34CO4)O2)O)O)C)CO

1 reference

language of work or name

NIVALENOL (English)

21 September 2016

Identifiers

InChI=1S/C15H20O7/c1-6-3-7-14(4-16,11(20)8(6)17)13(2)10(19)9(18)12(22-7)15(13)5-21-15/h3,7,9-12,16,18-20H,4-5H2,1-2H3/t7-,9-,10-,11-,12-,13-,14-,15?/m1/s1

1 reference

language of work or name

NIVALENOL (English)

21 September 2016

UKOTXHQERFPCBU-XLYGLCRNSA-N

1 reference

language of work or name

NIVALENOL (English)

21 September 2016

1 reference

language of work or name

Nivalenol (English)

21 September 2016

1 reference

language of work or name

NIVALENOL (English)

21 September 2016

UniChem compound ID

1 reference

1 reference

9 July 2020

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