(Q105262387)

English

5-hydroxy-8-methoxy-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

Isotectorigenin 4'-glucoside 7-rhamnoside

1 reference

based on heuristic

inferred from SMILES

mass

608.174120324 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₂O₁₅

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canonical SMILES

O=C1C(=COC2=C(OC)C(OC3OC(C)C(O)C(O)C3O)=CC(O)=C12)C=4C=CC(OC5OC(CO)C(O)C(O)C5O)=CC4

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isomeric SMILES

COc1c(O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc(O)c2c(=O)c(-c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3)coc12

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found in taxon

Salvia triloba

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stated in

Constituents from Salvia triloba

Salvia fruticosa

1 reference

stated in

Constituents from Salvia triloba

Identifiers

InChI

InChI=1S/C28H32O15/c1-10-18(31)21(34)23(36)27(40-10)42-15-7-14(30)17-19(32)13(9-39-26(17)25(15)38-2)11-3-5-12(6-4-11)41-28-24(37)22(35)20(33)16(8-29)43-28/h3-7,9-10,16,18,20-24,27-31,33-37H,8H2,1-2H3/t10-,16+,18-,20+,21+,22-,23+,24+,27-,28+/m0/s1

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InChIKey

SVRABECZTWRKCD-HTXKOFPHSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SVRABECZTWRKCD-HTXKOFPHSA-N

(Q105262387)

5-hydroxy-8-methoxy-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one

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Identifiers

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