(Q105183381)

English

(2S,3R,4S,5S,6R)-2-{[(11S)-11,17-dihydroxy-3,4-dimethoxytricyclo[12.3.1.1²,⁶]nonadeca-1(18),2,4,6(19),14,16-hexaen-5-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

chemical compound

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instance of

type of chemical entity

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subclass of

(2S,3R,4S,5S,6R)-2-[(11,17-dihydroxy-3,4-dimethoxy-5-tricyclo[12.3.1.12,6]nonadeca-1(17),2,4,6(19),14(18),15-hexaenyl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

Myricanol 5-glucoside

1 reference

based on heuristic

inferred from SMILES

mass

520.230847352 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Myricanol-15-glucoside

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₃₆O₁₀

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canonical SMILES

OC1=CC=C2C=C1C3=CC(=C(OC4OC(CO)C(O)C(O)C4O)C(OC)=C3OC)CCCCC(O)CC2

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isomeric SMILES

COc1c2cc(c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c1OC)CCCC[C@H](O)CCc1ccc(O)c-2c1

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found in taxon

Morella nana

1 reference

stated in

Three New Diarylheptanoids fromMyrica nana

Morella rubra

1 reference

stated in

Bioactive constituents of Chinese natural medicines. VII. Inhibitors of degranulation in RBL-2H3 cells and absolute stereostructures of three new diarylheptanoid glycosides from the bark of Myrica rubra

Myrica rubra

1 reference

stated in

Bioactive constituents of Chinese natural medicines. VII. Inhibitors of degranulation in RBL-2H3 cells and absolute stereostructures of three new diarylheptanoid glycosides from the bark of Myrica rubra

Identifiers

InChI

InChI=1S/C27H36O10/c1-34-25-18-12-15(5-3-4-6-16(29)9-7-14-8-10-19(30)17(18)11-14)24(26(25)35-2)37-27-23(33)22(32)21(31)20(13-28)36-27/h8,10-12,16,20-23,27-33H,3-7,9,13H2,1-2H3/t16-,20+,21+,22-,23+,27-/m0/s1

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InChIKey

NPSYWDNXSMBWKP-KUKUFDJQSA-N

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1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105183381)

(2S,3R,4S,5S,6R)-2-{[(11S)-11,17-dihydroxy-3,4-dimethoxytricyclo[12.3.1.1²,⁶]nonadeca-1(18),2,4,6(19),14,16-hexaen-5-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

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