(Q105016820)

English

(2S)-2,6-dihydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[[4-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]methyl]-1-benzofuran-3-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

596.174120324 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₃₂O₁₅

0 references

canonical SMILES

O=C1C=2C(OC3OC(CO)C(O)C(O)C3O)=CC(O)=CC2OC1(O)CC4=CC=C(OC5OC(C)C(O)C(O)C5O)C=C4

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isomeric SMILES

C[C@@H]1O[C@@H](Oc2ccc(C[C@]3(O)Oc4cc(O)cc(O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)c4C3=O)cc2)[C@@H](O)[C@H](O)[C@H]1O

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found in taxon

Hovenia trichocarpa

2 references

stated in

Hovetrichosides C-G, five new glycosides of two auronols, two neolignans, and a phenylpropanoid from the bark of Hovenia trichocarea

stated in

Isolation and absolute structures of enantiomeric 1,2-bis(4-hydroxy-3-methoxyphenyl)-1,3-propanediol 1-O-glucosides from the bark of Hovenia trichocarpa

Identifiers

InChI

InChI=1S/C27H32O15/c1-10-18(30)20(32)22(34)25(38-10)39-13-4-2-11(3-5-13)8-27(37)24(36)17-14(6-12(29)7-15(17)42-27)40-26-23(35)21(33)19(31)16(9-28)41-26/h2-7,10,16,18-23,25-26,28-35,37H,8-9H2,1H3/t10-,16+,18-,19-,20+,21-,22-,23+,25-,26+,27-/m0/s1

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InChIKey

GRXIBUCMIOIMAU-DQYBRJHGSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105016820)

(2S)-2,6-dihydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[[4-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]methyl]-1-benzofuran-3-one

Statements

Identifiers

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