(Q105171391)

English

(1R,5R,11R,12S,15R,16S)-16-[(2S)-2-hydroxy-5-oxo-2H-furan-3-yl]-6,6,11,15-tetramethyl-7,17-dioxatetracyclo[13.2.1.01,12.05,11]octadec-9-ene-3,8,18-trione

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

16-(2-hydroxy-5-oxo-2H-furan-3-yl)-6,6,11,15-tetramethyl-7,17-dioxatetracyclo[13.2.1.01,12.05,11]octadec-9-ene-3,8,18-trione

1 reference

based on heuristic

inferred from SMILES

mass

444.178417856 dalton

1 reference

1 reference

C₂₄H₂₈O₈

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canonical SMILES

O=C1OC(O)C(=C1)C2OC34C(=O)C2(C)CCC3C5(C=CC(=O)OC(C)(C)C5CC(=O)C4)C

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isomeric SMILES

CC1(C)OC(=O)C=C[C@@]2(C)[C@@H]3CC[C@@]4(C)C(=O)[C@]3(CC(=O)C[C@@H]12)O[C@H]4C1=CC(=O)O[C@@H]1O

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found in taxon

Cedrelopsis grevei

1 reference

stated in

Secondary metabolites from Cedrelopsis grevei (Ptaeroxylaceae).

Identifiers

InChI

InChI=1S/C24H28O8/c1-21(2)15-9-12(25)11-24-14(22(15,3)8-6-16(26)31-21)5-7-23(4,20(24)29)18(32-24)13-10-17(27)30-19(13)28/h6,8,10,14-15,18-19,28H,5,7,9,11H2,1-4H3/t14-,15-,18-,19-,22-,23+,24+/m0/s1

0 references

InChIKey

MSSXDTAEWFZRTE-VYIMANMWSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MSSXDTAEWFZRTE-VYIMANMWSA-N

(Q105171391)

(1R,5R,11R,12S,15R,16S)-16-[(2S)-2-hydroxy-5-oxo-2H-furan-3-yl]-6,6,11,15-tetramethyl-7,17-dioxatetracyclo[13.2.1.01,12.05,11]octadec-9-ene-3,8,18-trione

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Identifiers

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