(Q105205263)

English

(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-{4-[(2S,3R,4R)-3-(hydroxymethyl)-4-[(3-methoxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl]oxolan-2-yl]-2-methoxyphenoxy}oxane-3,4,5-triol

chemical compound

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instance of

type of chemical entity

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subclass of

2-(Hydroxymethyl)-6-[4-[[4-(hydroxymethyl)-5-[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]oxolan-3-yl]methyl]-2-methoxyphenoxy]oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

684.262935328 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(+)-Lariciresinol 4,4'-bis(beta-D-glucopyranoside)

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2S,3R,4R,5S,6R)-2-(hydroxymethyl)-6-[4-[[(3S,4S,5R)-4-(hydroxymethyl)-5-[3-methoxy-4-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]oxolan-3-yl]methyl]-2-methoxyphenoxy]oxane-3,4,5-triol

1 reference

based on heuristic

inferred from InChI

(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[4-[[(3R,4R,5S)-4-(hydroxymethyl)-5-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]oxolan-3-yl]methyl]-2-methoxyphenoxy]oxane-3,4,5-triol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₂H₄₄O₁₆

0 references

canonical SMILES

OCC1OC(OC2=CC=C(C=C2OC)CC3COC(C4=CC=C(OC5OC(CO)C(O)C(O)C5O)C(OC)=C4)C3CO)C(O)C(O)C1O

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isomeric SMILES

COc1cc(C[C@H]2CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

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found in taxon

Clematis stans

1 reference

stated in

Studies on the constituents of Clematis species. VI. The constituents of Clematis stans Sieb. et Zucc

Albugo candida

1 reference

stated in

Phytoalexins and polar metabolites from the oilseeds canola and rapeseed: differential metabolic responses to the biotroph Albugo candida and to abiotic stress

Brassica rapa

1 reference

stated in

Sinalexin, a phytoalexin from white mustard elicited by destruxin B and Alternaria brassicae

Galium sinaicum

1 reference

stated in

Lignan bis-glucosides from Galium sinaicum

Plocama calabrica

1 reference

stated in

Flavonoid, iridoid, and lignan glycosides from Putoria calabrica

Sedum sarmentosum

2 references

stated in

Bioactive constituents from Chinese natural medicines. XXII. Absolute structures of new megastigmane glycosides, sedumosides E1, E2, E3, F1, F2, and G, from Sedum sarmentosum (Crassulaceae)

stated in

Bioactive Constituents from Chinese Natural Medicines. XXV. New Flavonol Bisdesmosides, Sarmenosides I, II, III, and IV, with Hepatoprotective Activity from Sedum sarmentosum (Crassulaceae)

Identifiers

InChI

InChI=1S/C32H44O16/c1-42-20-8-14(3-5-18(20)45-31-28(40)26(38)24(36)22(11-34)47-31)7-16-13-44-30(17(16)10-33)15-4-6-19(21(9-15)43-2)46-32-29(41)27(39)25(37)23(12-35)48-32/h3-6,8-9,16-17,22-41H,7,10-13H2,1-2H3/t16-,17-,22+,23+,24+,25+,26-,27-,28+,29+,30+,31+,32+/m0/s1

0 references

InChIKey

PBLWZMSRSJTRHJ-NCIRKIHRSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PBLWZMSRSJTRHJ-NCIRKIHRSA-N

1 reference

2 references

inferred from InChIKey

matched by identifier from

InChIKey

PBLWZMSRSJTRHJ-NCIRKIHRSA-N

(Q105205263)

(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-{4-[(2S,3R,4R)-3-(hydroxymethyl)-4-[(3-methoxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl]oxolan-2-yl]-2-methoxyphenoxy}oxane-3,4,5-triol

Statements

Identifiers

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