(Q104989500)

English

[(1S,12R,13R)-16,17-dimethoxy-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),5,9,14,16,18-heptaen-12-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

12-Deoxo-12|A-acetoxyelliptone

1 reference

based on heuristic

inferred from SMILES

mass

396.12090298 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,12S,13R)-16,17-dimethoxy-2,7,20-trioxapentacyclo[11.8.0.0³,¹¹.0⁴,⁸.0¹⁴,¹⁹]henicosa-3,5,8,10,14(19),15,17-heptaen-12-yl acetate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₀O₇

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canonical SMILES

O=C(OC1C2=CC=C3OC=CC3=C2OC4COC5=CC(OC)=C(OC)C=C5C14)C

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isomeric SMILES

COc1cc2c(cc1OC)[C@H]1[C@@H](CO2)Oc2c(ccc3occc23)[C@@H]1OC(C)=O

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found in taxon

Derris malaccensis

1 reference

stated in

A New 12a-Hydroxyelliptone from the Stems of Derris malaccensis

Derris montana

1 reference

stated in

A New 12a-Hydroxyelliptone from the Stems of Derris malaccensis

Identifiers

InChI

InChI=1S/C22H20O7/c1-11(23)28-22-13-4-5-15-12(6-7-26-15)21(13)29-19-10-27-16-9-18(25-3)17(24-2)8-14(16)20(19)22/h4-9,19-20,22H,10H2,1-3H3/t19-,20+,22+/m1/s1

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InChIKey

DUWADQUXPNOAOS-URVUXULASA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DUWADQUXPNOAOS-URVUXULASA-N

(Q104989500)

[(1S,12R,13R)-16,17-dimethoxy-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),5,9,14,16,18-heptaen-12-yl] acetate

Statements

Identifiers

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