(Q105299624)

English

(2R,3R,4S,5S,6R)-2-[(2S,3R)-3-hydroxy-2-[2-hydroxy-4-(3-hydroxypropyl)phenoxy]-3-(4-hydroxy-3-methoxyphenyl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

2-[3-Hydroxy-2-[2-hydroxy-4-(3-hydroxypropyl)phenoxy]-3-(4-hydroxy-3-methoxyphenyl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

526.205026528 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₃₄O₁₂

0 references

canonical SMILES

OC1=CC=C(C=C1OC)C(O)C(OC2=CC=C(C=C2O)CCCO)COC3OC(CO)C(O)C(O)C3O

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isomeric SMILES

COc1cc([C@@H](O)[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Oc2ccc(CCCO)cc2O)ccc1O

0 references

found in taxon

Pinus massoniana

1 reference

stated in

The Constituents of Conifer Needles. Dilignol Glycosides from Pinus massoniana Lamb.

Identifiers

InChI

InChI=1S/C25H34O12/c1-34-18-10-14(5-6-15(18)28)21(30)20(36-17-7-4-13(3-2-8-26)9-16(17)29)12-35-25-24(33)23(32)22(31)19(11-27)37-25/h4-7,9-10,19-33H,2-3,8,11-12H2,1H3/t19-,20+,21-,22-,23+,24-,25-/m1/s1

0 references

InChIKey

VZBPOJAXRHFNRT-IKNZJXHLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VZBPOJAXRHFNRT-IKNZJXHLSA-N

(Q105299624)

(2R,3R,4S,5S,6R)-2-[(2S,3R)-3-hydroxy-2-[2-hydroxy-4-(3-hydroxypropyl)phenoxy]-3-(4-hydroxy-3-methoxyphenyl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

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Identifiers

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