(Q104938440)

English

3-[(5R)-3,4-dihydroxy-5-[(5R)-3,4,5-trihydroxy-6-[[(2R,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one

group of stereoisomers with the chemical formula C₃₃H₄₀O₂₀

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Statements

instance of

group of stereoisomers

0 references

1 reference

756.21129368 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₄₀O₂₀

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canonical SMILES

O=C1C(OC2OCC(OC3OC(COC4OC(C)C(O)C(O)C4O)C(O)C(O)C3O)C(O)C2O)=C(OC=5C=C(O)C=C(O)C15)C=6C=CC(O)=C(OC)C6

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isomeric SMILES

COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2OC[C@@H](OC3OC(CO[C@@H]4OC(C)[C@H](O)[C@H](O)C4O)[C@H](O)C(O)C3O)C(O)C2O)ccc1O

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found in taxon

Nitraria retusa

1 reference

stated in

Flavonol glycosides from Nitraria retusa

Identifiers

InChI

InChI=1S/C33H40O20/c1-10-20(37)24(41)27(44)31(49-10)47-8-17-21(38)25(42)28(45)33(51-17)52-18-9-48-32(26(43)22(18)39)53-30-23(40)19-14(36)6-12(34)7-16(19)50-29(30)11-3-4-13(35)15(5-11)46-2/h3-7,10,17-18,20-22,24-28,31-39,41-45H,8-9H2,1-2H3/t10?,17?,18-,20+,21+,22?,24+,25?,26?,27?,28?,31-,32?,33?/m1/s1

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InChIKey

BMLFZGYQGSVVGU-CTFMKGLLSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BMLFZGYQGSVVGU-CTFMKGLLSA-N

(Q104938440)

3-[(5R)-3,4-dihydroxy-5-[(5R)-3,4,5-trihydroxy-6-[[(2R,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one

Statements

Identifiers

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