(Q105298840)

English

(3S,4S)-3-hydroxy-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-[[3-methoxy-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one

chemical compound

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instance of

type of chemical entity

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subclass of

3-Hydroxy-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-[[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

536.189376464 dalton

1 reference

1 reference

(3R,4R)-3-hydroxy-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-[[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₆H₃₂O₁₂

0 references

canonical SMILES

O=C1OCC(CC2=CC=C(O)C(OC)=C2)C1(O)CC3=CC=C(OC4OC(CO)C(O)C(O)C4O)C(OC)=C3

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isomeric SMILES

COc1cc(C[C@H]2COC(=O)[C@]2(O)Cc2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c(OC)c2)ccc1O

0 references

found in taxon

Daphne feddei

1 reference

stated in

Phenylpropanoids from Daphne feddei and their inhibitory activities against NO production

Selaginella doederleinii

1 reference

stated in

Phenolic Constituents of Selaginella doederleinii

Identifiers

InChI

InChI=1S/C26H32O12/c1-34-18-8-13(3-5-16(18)28)7-15-12-36-25(32)26(15,33)10-14-4-6-17(19(9-14)35-2)37-24-23(31)22(30)21(29)20(11-27)38-24/h3-6,8-9,15,20-24,27-31,33H,7,10-12H2,1-2H3/t15-,20-,21+,22-,23-,24+,26-/m0/s1

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InChIKey

VXYKGOAXVHSLDD-GAZHODSISA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VXYKGOAXVHSLDD-GAZHODSISA-N

(Q105298840)

(3S,4S)-3-hydroxy-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-[[3-methoxy-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one

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