(Q105207685)

English

(4R,5S)-1,5-Bis(3,4-dihydroxyphenyl)-4-(beta-D-glucopyranosyloxy)-5-methoxy-1-pentyne

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

2-[1,5-Bis(3,4-dihydroxyphenyl)-1-methoxypent-4-yn-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

492.163161716 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(4R,5R)-1,5-Bis(3,4-dihydroxyphenyl)-4-(beta-D-glucopyranosyloxy)-5-methoxy-1-pentyne

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2R,3R,4S,5R,6R)-2-[(1S,2R)-1,5-bis(3,4-dihydroxyphenyl)-1-methoxypent-4-yn-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

1-O-methylnyasicoside

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₄H₂₈O₁₁

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canonical SMILES

OC1=CC=C(C#CCC(OC2OC(CO)C(O)C(O)C2O)C(OC)C3=CC=C(O)C(O)=C3)C=C1O

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isomeric SMILES

CO[C@@H](c1ccc(O)c(O)c1)[C@@H](CC#Cc1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

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found in taxon

Molineria crassifolia

1 reference

stated in

New acetylenic norlignan compounds from rhizomes of Curculigo crassifolia

Curculigo crassifolia

1 reference

stated in

New acetylenic norlignan compounds from rhizomes of Curculigo crassifolia

Identifiers

InChI

InChI=1S/C24H28O11/c1-33-23(13-6-8-15(27)17(29)10-13)18(4-2-3-12-5-7-14(26)16(28)9-12)34-24-22(32)21(31)20(30)19(11-25)35-24/h5-10,18-32H,4,11H2,1H3/t18-,19-,20-,21+,22-,23+,24-/m1/s1

0 references

InChIKey

PFEGVXNNPUKZKH-MOYMBFSLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PFEGVXNNPUKZKH-MOYMBFSLSA-N

1 reference

(Q105207685)

(4R,5S)-1,5-Bis(3,4-dihydroxyphenyl)-4-(beta-D-glucopyranosyloxy)-5-methoxy-1-pentyne

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