(Q104924438)

English

[(1R,3S,5S,7R,9S,10S,14S,16S)-3-methoxy-3,16-dimethyl-8,13-dimethylidene-12-oxo-2,4,11-trioxatetracyclo[7.6.1.05,16.010,14]hexadecan-7-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

Furo[3',2':3,4]naphtho[1,8-de][1,3]dioxin-9(1H)-one, 2-(acetyloxy)decahydro-5-methoxy-5,10c-dimethyl-1,8-bis(methylene)-, (2R,3aS,5S,6aR,7aS,10aS,10bS,10cS)-

1 reference

based on heuristic

inferred from SMILES

mass

378.167853172 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1R,3S,5S,7R,9S,10R,14S,16S)-3-methoxy-3,16-dimethyl-8,13-dimethylidene-12-oxo-2,4,11-trioxatetracyclo[7.6.1.05,16.010,14]hexadecan-7-yl] acetate

1 reference

based on heuristic

inferred from InChIKey

chemical formula

C₂₀H₂₆O₇

0 references

canonical SMILES

O=C1OC2C(C1=C)CC3OC(OC)(OC4CC(OC(=O)C)C(=C)C2C43C)C

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isomeric SMILES

C=C1C(=O)O[C@H]2[C@H]1C[C@H]1O[C@](C)(OC)O[C@H]3C[C@@H](OC(C)=O)C(=C)[C@H]2[C@]31C

0 references

found in taxon

Cratystylis conocephala

1 reference

stated in

Eudesmanolides and other constituents from Cratystylis conocephala

Identifiers

InChI

InChI=1S/C20H26O7/c1-9-12-7-14-19(4)15(27-20(5,23-6)26-14)8-13(24-11(3)21)10(2)16(19)17(12)25-18(9)22/h12-17H,1-2,7-8H2,3-6H3/t12-,13+,14+,15-,16+,17-,19-,20-/m0/s1

0 references

InChIKey

BDMQAFITOHQEJV-TUBGJQBHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BDMQAFITOHQEJV-TUBGJQBHSA-N

(Q104924438)

[(1R,3S,5S,7R,9S,10S,14S,16S)-3-methoxy-3,16-dimethyl-8,13-dimethylidene-12-oxo-2,4,11-trioxatetracyclo[7.6.1.05,16.010,14]hexadecan-7-yl] acetate

Statements

Identifiers

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