(Q105247883)

English

(2R,3R,4S,5S,6R)-2-[(2R,3R)-2,3-bis(1,3-benzodioxol-5-ylmethyl)-4-hydroxybutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

2-[2,3-Bis(1,3-benzodioxol-5-ylmethyl)-4-hydroxybutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

(2R,3R,4S,5S,6R)-2-[(3R)-2,3-bis(2H-1,3-benzodioxol-5-ylmethyl)-4-hydroxybutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

520.194461844 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₃₂O₁₁

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canonical SMILES

OCC1OC(OCC(CC2=CC=C3OCOC3=C2)C(CO)CC4=CC=C5OCOC5=C4)C(O)C(O)C1O

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isomeric SMILES

OC[C@H]1O[C@@H](OC[C@H](Cc2ccc3c(c2)OCO3)[C@H](CO)Cc2ccc3c(c2)OCO3)[C@H](O)[C@@H](O)[C@@H]1O

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found in taxon

Tetracentron sinense

2 references

stated in

Two glycosides from the stem bark of Tetracentron sinense.

stated in

Two glycosides from the stem bark of Tetracentron sinense.

Identifiers

InChI

InChI=1S/C26H32O11/c27-9-16(5-14-1-3-18-20(7-14)35-12-33-18)17(6-15-2-4-19-21(8-15)36-13-34-19)11-32-26-25(31)24(30)23(29)22(10-28)37-26/h1-4,7-8,16-17,22-31H,5-6,9-13H2/t16-,17-,22+,23+,24-,25+,26+/m0/s1

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InChIKey

RYQGXMHEFILHCV-DNABOVRESA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RYQGXMHEFILHCV-DNABOVRESA-N

1 reference

(Q105247883)

(2R,3R,4S,5S,6R)-2-[(2R,3R)-2,3-bis(1,3-benzodioxol-5-ylmethyl)-4-hydroxybutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Statements

Identifiers

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