(Q104922297)

English

[(8R,9R,10S,11S)-3,9,19-trihydroxy-4,5-dimethoxy-9,10-dimethyl-8-[(E)-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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subclass of

[3,9,19-Trihydroxy-4,5-dimethoxy-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

584.225761972 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(8S,9S,10S,11R)-3,9,19-trihydroxy-4,5-dimethoxy-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

2 references

based on heuristic

inferred from InChIKey

1 reference

C₃₁H₃₆O₁₁

0 references

canonical SMILES

O=C(OC1C=2C=C3OCOC3=C(O)C2C4=C(O)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]1c2cc3c(c(O)c2-c2c(cc(OC)c(OC)c2O)[C@@H](OC(=O)/C(C)=C/C)[C@](C)(O)[C@H]1C)OCO3

0 references

found in taxon

Schisandra propinqua

1 reference

stated in

A new triterpene and dibenzocyclooctadiene lignans from Schisandra propinqua (WALL.) BAILL.

Identifiers

InChI

InChI=1S/C31H36O11/c1-9-14(3)29(34)41-25-16(5)31(6,36)28(42-30(35)15(4)10-2)18-12-19(37-7)26(38-8)23(32)22(18)21-17(25)11-20-27(24(21)33)40-13-39-20/h9-12,16,25,28,32-33,36H,13H2,1-8H3/b14-9-,15-10+/t16-,25-,28+,31+/m0/s1

0 references

InChIKey

BAMNGVHFHRSHFX-PVRBFIQASA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q104922297)

[(8R,9R,10S,11S)-3,9,19-trihydroxy-4,5-dimethoxy-9,10-dimethyl-8-[(E)-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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