(Q104983208)

English

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

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

[3,4-Dihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-yl] acetate

1 reference

based on heuristic

inferred from SMILES

mass

340.152203108 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

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

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₄O₇

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canonical SMILES

O=C(OC1CC2(C)C3(OC3)C1OC4C=C(C)C(O)C(O)C42CO)C

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isomeric SMILES

CC(=O)O[C@@H]1C[C@@]2(C)[C@]3(CO3)[C@@H]1O[C@H]1C=C(C)[C@@H](O)[C@@H](O)[C@@]12CO

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found in taxon

Fusarium culmorum

1 reference

stated in

Potential inhibitors of trichothecene biosynthesis in Fusarium culmorum: Epoxidation of a trichodiene derivative

Identifiers

InChI

InChI=1S/C17H24O7/c1-8-4-11-16(6-18,13(21)12(8)20)15(3)5-10(23-9(2)19)14(24-11)17(15)7-22-17/h4,10-14,18,20-21H,5-7H2,1-3H3/t10-,11+,12-,13-,14-,15-,16-,17+/m1/s1

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InChIKey

DKGWXKBZPBPUBK-CZGWVLNJSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DKGWXKBZPBPUBK-CZGWVLNJSA-N

(Q104983208)

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

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Identifiers

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