(Q105256112)

English

3-O-[(2S,3R,4S,5S,6S)-4,5-dihydroxy-2-[5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy-6-methoxycarbonyloxan-3-yl] 1-O-methyl propanedioate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

3-O-[4,5-dihydroxy-2-[5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy-6-methoxycarbonyloxan-3-yl] 1-O-methyl propanedioate

1 reference

based on heuristic

inferred from SMILES

mass

590.127170132 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₂₆O₁₅

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canonical SMILES

O=C(OC)CC(=O)OC1C(OC2=CC(O)=C3C(=O)C=C(OC3=C2)C=4C=CC(OC)=C(O)C4)OC(C(=O)OC)C(O)C1O

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isomeric SMILES

COC(=O)CC(=O)O[C@H]1[C@H](Oc2cc(O)c3c(=O)cc(-c4ccc(OC)c(O)c4)oc3c2)O[C@H](C(=O)OC)[C@@H](O)[C@@H]1O

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found in taxon

Meehania fargesii

1 reference

stated in

Cyclic spermidine alkaloids and flavone glycosides from Meehania fargesii

Identifiers

InChI

InChI=1S/C27H26O15/c1-36-16-5-4-11(6-13(16)28)17-9-15(30)21-14(29)7-12(8-18(21)40-17)39-27-25(41-20(32)10-19(31)37-2)23(34)22(33)24(42-27)26(35)38-3/h4-9,22-25,27-29,33-34H,10H2,1-3H3/t22-,23-,24-,25+,27+/m0/s1

0 references

InChIKey

SMQZJGPKINBXGZ-HDHXAKMKSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SMQZJGPKINBXGZ-HDHXAKMKSA-N

1 reference

(Q105256112)

3-O-[(2S,3R,4S,5S,6S)-4,5-dihydroxy-2-[5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy-6-methoxycarbonyloxan-3-yl] 1-O-methyl propanedioate

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Identifiers

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