(Q105118667)

English

[(1S,2S,3S,6R)-2-[(3R)-3-[(3R,5R)-5-(furan-3-yl)-2-oxooxolan-3-yl]butyl]-1,2-dimethyl-7-oxabicyclo[4.1.0]heptan-3-yl] (Z)-2-methylbut-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[2-[3-[5-(Furan-3-yl)-2-oxooxolan-3-yl]butyl]-1,2-dimethyl-7-oxabicyclo[4.1.0]heptan-3-yl] 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

430.235538808 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1S,2S,3S,6R)-2-[(3R)-3-[(3R,5R)-5-(furan-3-yl)-2-oxooxolan-3-yl]butyl]-1,2-dimethyl-7-oxabicyclo[4.1.0]heptan-3-yl] (E)-2-methylbut-2-enoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₅H₃₄O₆

0 references

canonical SMILES

O=C(OC1CCC2OC2(C)C1(C)CCC(C)C3C(=O)OC(C4=COC=C4)C3)C(=CC)C

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isomeric SMILES

C/C=C(/C)C(=O)O[C@H]1CC[C@H]2O[C@@]2(C)[C@@]1(C)CC[C@@H](C)[C@H]1C[C@H](c2ccoc2)OC1=O

0 references

found in taxon

Microglossa pyrifolia

2 references

stated in

Diterpenes and sesquiterpene xylosides from east africanConyza species

stated in

Rearranged clerodanes and other diterpenes fromMicroglossa pyrrhopappa

Identifiers

InChI

InChI=1S/C25H34O6/c1-6-15(2)22(26)30-20-7-8-21-25(5,31-21)24(20,4)11-9-16(3)18-13-19(29-23(18)27)17-10-12-28-14-17/h6,10,12,14,16,18-21H,7-9,11,13H2,1-5H3/b15-6-/t16-,18-,19-,20+,21-,24+,25-/m1/s1

0 references

InChIKey

IQWVYHNJJAJYJE-FZYSJFCOSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IQWVYHNJJAJYJE-FZYSJFCOSA-N

(Q105118667)

[(1S,2S,3S,6R)-2-[(3R)-3-[(3R,5R)-5-(furan-3-yl)-2-oxooxolan-3-yl]butyl]-1,2-dimethyl-7-oxabicyclo[4.1.0]heptan-3-yl] (Z)-2-methylbut-2-enoate

Statements

Identifiers

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