(Q105324070)

English

(2R,3R,4S,5R,6S)-4-[(2S,3S,4S)-3,4-dihydroxy-4-methoxyoxolan-2-yl]oxy-2-(hydroxymethyl)-6-[4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenoxy]oxane-3,5-diol

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

4-(3,4-Dihydroxy-4-methoxyoxolan-2-yl)oxy-2-(hydroxymethyl)-6-[4-(3-hydroxyprop-1-enyl)-2,6-dimethoxyphenoxy]oxane-3,5-diol

1 reference

based on heuristic

inferred from SMILES

mass

504.184291084 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₂O₁₃

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canonical SMILES

OCC=CC1=CC(OC)=C(OC2OC(CO)C(O)C(OC3OCC(O)(OC)C3O)C2O)C(OC)=C1

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isomeric SMILES

COc1cc(/C=C/CO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[C@@H]2OC[C@](O)(OC)[C@H]2O)[C@H]1O

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found in taxon

Tinospora sinensis

1 reference

stated in

New lignan glucosides from the stems of Tinospora sinensis

Identifiers

InChI

InChI=1S/C22H32O13/c1-29-12-7-11(5-4-6-23)8-13(30-2)17(12)34-20-16(26)18(15(25)14(9-24)33-20)35-21-19(27)22(28,31-3)10-32-21/h4-5,7-8,14-16,18-21,23-28H,6,9-10H2,1-3H3/b5-4+/t14-,15-,16-,18+,19+,20+,21+,22+/m1/s1

0 references

InChIKey

XAQYJBISYKLVEE-SWAXMWKRSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XAQYJBISYKLVEE-SWAXMWKRSA-N

(Q105324070)

(2R,3R,4S,5R,6S)-4-[(2S,3S,4S)-3,4-dihydroxy-4-methoxyoxolan-2-yl]oxy-2-(hydroxymethyl)-6-[4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenoxy]oxane-3,5-diol

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Identifiers

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