(Q104921091)

English

[(4S,6R,10Z,11aR)-6-acetyloxy-3-(acetyloxymethyl)-6,10-dimethyl-2,7-dioxo-5,8,9,11a-tetrahydro-4H-cyclodeca[b]furan-4-yl] 2-methylprop-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

germacrane sesquiterpenoid

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mass

448.173332476 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₃H₂₈O₉

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canonical SMILES

O=C(OC1C2=C(C(=O)OC2C=C(C)CCC(=O)C(OC(=O)C)(C)C1)COC(=O)C)C(=C)C

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isomeric SMILES

C=C(C)C(=O)O[C@H]1C[C@@](C)(OC(C)=O)C(=O)CC/C(C)=C\[C@H]2OC(=O)C(COC(C)=O)=C12

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found in taxon

Disynaphia halimifolia

1 reference

stated in

Two sesquiterpene lactones with an additional propiolactone ring from Disynaphia halimifolia

Identifiers

InChI

InChI=1S/C23H28O9/c1-12(2)21(27)31-18-10-23(6,32-15(5)25)19(26)8-7-13(3)9-17-20(18)16(22(28)30-17)11-29-14(4)24/h9,17-18H,1,7-8,10-11H2,2-6H3/b13-9-/t17-,18+,23-/m1/s1

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InChIKey

AYGIXFJCJFNCRB-IWDSTLHOSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

AYGIXFJCJFNCRB-IWDSTLHOSA-N

(Q104921091)

[(4S,6R,10Z,11aR)-6-acetyloxy-3-(acetyloxymethyl)-6,10-dimethyl-2,7-dioxo-5,8,9,11a-tetrahydro-4H-cyclodeca[b]furan-4-yl] 2-methylprop-2-enoate

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Identifiers

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