(Q105255041)

English

[(1R,2R,4S,5R,6S,9S,10R,11S,13S)-10-chloro-2,11-dihydroxy-2,6,11-trimethyl-7-oxo-8,14-dioxatetracyclo[8.4.0.01,13.05,9]tetradecan-4-yl] 2-methylpropanoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

(10-Chloro-2,11-dihydroxy-2,6,11-trimethyl-7-oxo-8,14-dioxatetracyclo[8.4.0.01,13.05,9]tetradecan-4-yl) 2-methylpropanoate

1 reference

based on heuristic

inferred from SMILES

mass

402.144530884 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₂₇ClO₇

0 references

canonical SMILES

O=C(OC1CC(O)(C)C23OC3CC(O)(C)C2(Cl)C4OC(=O)C(C)C14)C(C)C

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isomeric SMILES

CC(C)C(=O)O[C@H]1C[C@@](C)(O)[C@]23O[C@H]2C[C@](C)(O)[C@]3(Cl)[C@H]2OC(=O)[C@@H](C)[C@H]12

0 references

found in taxon

Otanthus maritimus

1 reference

stated in

Highly oxygenated guaianolides from Otanthus maritimus

Identifiers

InChI

InChI=1S/C19H27ClO7/c1-8(2)14(21)25-10-6-17(5,24)19-11(27-19)7-16(4,23)18(19,20)13-12(10)9(3)15(22)26-13/h8-13,23-24H,6-7H2,1-5H3/t9-,10-,11-,12+,13-,16-,17+,18+,19+/m0/s1

0 references

InChIKey

SKUDQVAPWPVZPH-HFDQNHLESA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SKUDQVAPWPVZPH-HFDQNHLESA-N

(Q105255041)

[(1R,2R,4S,5R,6S,9S,10R,11S,13S)-10-chloro-2,11-dihydroxy-2,6,11-trimethyl-7-oxo-8,14-dioxatetracyclo[8.4.0.01,13.05,9]tetradecan-4-yl] 2-methylpropanoate

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Identifiers

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