(Q110080945)

English

CJGMMNTVAMNBRH-UHFFFAOYSA-O

group of stereoisomers with the chemical formula C₅₆H₅₉O₃₀⁺

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Statements

group of stereoisomers

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1,211.30856690809 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₅₆H₅₉O₃₀⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

O=C(O)CC(=O)OCC1OC(OC2=CC(O)=CC=3[O+]=C(C(OC4OC(COC(=O)C=CC5=CC=C(O)C(OC)=C5)C(O)C(O)C4OC6OCC(O)C(O)C6OC(=O)C=CC7=CC(OC)=C(O)C(OC)=C7)=CC23)C=8C=CC(O)=C(O)C8)C(O)C(O)C1O

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Matthiola incana

1 reference

Acylated cyanidin 3-sambubioside-5-glucosides in Matthiola incana

Identifiers

InChI=1S/C56H58O30/c1-74-34-12-23(4-8-29(34)59)5-10-41(64)77-21-39-47(70)49(72)53(86-55-52(44(67)31(61)20-79-55)85-42(65)11-6-24-13-35(75-2)45(68)36(14-24)76-3)56(84-39)82-37-18-27-32(80-51(37)25-7-9-28(58)30(60)15-25)16-26(57)17-33(27)81-54-50(73)48(71)46(69)38(83-54)22-78-43(66)19-40(62)63/h4-18,31,38-39,44,46-50,52-56,61,67,69-73H,19-22H2,1-3H3,(H5-,57,58,59,60,62,63,64,65,68)/p+1

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CJGMMNTVAMNBRH-UHFFFAOYSA-O

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2 references

15 September 2022

matched by identifier from

CJGMMNTVAMNBRH-UHFFFAOYSA-O

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