(Q110076606)

English

[(2R,4S,7R,9R,10R,11S)-11-acetyloxy-2-(acetyloxymethyl)-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 2-methylpropanoate

group of stereoisomers with the chemical formula C₂₃H₃₂O₉

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

452.204632604 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₃H₃₂O₉

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canonical SMILES

O=C(OCC12CC(OC(=O)C(C)C)C(=CC2OC3C(O)C(OC(=O)C)C1(C)C43OC4)C)C

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isomeric SMILES

CC(=O)OC[C@]12C[C@H](OC(=O)C(C)C)C(C)=C[C@H]1O[C@@H]1[C@H](O)[C@@H](OC(C)=O)C2(C)C12CO2

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found in taxon

Fusarium sporotrichioides

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stated in

The structures of toxins from two strains of Fusarium tricinctum

Identifiers

InChI

InChI=1S/C23H32O9/c1-11(2)20(27)31-15-8-22(9-28-13(4)24)16(7-12(15)3)32-19-17(26)18(30-14(5)25)21(22,6)23(19)10-29-23/h7,11,15-19,26H,8-10H2,1-6H3/t15-,16+,17+,18+,19+,21?,22+,23?/m0/s1

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InChIKey

CZZOBJORBLRBLT-YUGJVSBZSA-N

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CAS Registry Number

111112-48-2

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stated in

CAS (formerly Chemical Abstracts Service)

25 January 2022

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CZZOBJORBLRBLT-YUGJVSBZSA-N

KNApSAcK ID

C00056458

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

CZZOBJORBLRBLT-YUGJVSBZSA-N

(Q110076606)

[(2R,4S,7R,9R,10R,11S)-11-acetyloxy-2-(acetyloxymethyl)-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 2-methylpropanoate

Statements

Identifiers

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