(Q105387187)

English

[(8S,9S,10S,11R)-9,19-dihydroxy-3,4,5-trimethoxy-9,10-dimethyl-8-[(Z)-2-methylbut-2-enoyl]oxy-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-yl] (Z)-2-methylbut-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

[9,19-Dihydroxy-3,4,5-trimethoxy-9,10-dimethyl-8-(2-methylbut-2-enoyloxy)-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-yl] 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

598.241412036 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₃₈O₁₁

0 references

canonical SMILES

O=C(OC1C=2C=C3OCOC3=C(O)C2C4=C(OC)C(OC)=C(OC)C=C4C(OC(=O)C(=CC)C)C(O)(C)C1C)C(=CC)C

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isomeric SMILES

C/C=C(/C)C(=O)O[C@H]1c2cc(OC)c(OC)c(OC)c2-c2c(cc3c(c2O)OCO3)[C@H](OC(=O)/C(C)=C\C)[C@H](C)[C@]1(C)O

0 references

found in taxon

Kadsura japonica

1 reference

stated in

Antihepatitis activity (anti-HBsAg and anti-HBeAg) of C19 homolignans and six novel C18 dibenzocyclooctadiene lignans from Kadsura japonica.

Identifiers

InChI

InChI=1S/C32H38O11/c1-10-15(3)30(34)42-25-17(5)32(6,36)29(43-31(35)16(4)11-2)19-13-20(37-7)27(38-8)28(39-9)23(19)22-18(25)12-21-26(24(22)33)41-14-40-21/h10-13,17,25,29,33,36H,14H2,1-9H3/b15-10-,16-11-/t17-,25+,29-,32-/m0/s1

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InChIKey

ZZYDJTYGDOTXLA-ROMKREOTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ZZYDJTYGDOTXLA-ROMKREOTSA-N

(Q105387187)

[(8S,9S,10S,11R)-9,19-dihydroxy-3,4,5-trimethoxy-9,10-dimethyl-8-[(Z)-2-methylbut-2-enoyl]oxy-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-yl] (Z)-2-methylbut-2-enoate

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