(Q110081263)

English

VYROXVUTZWOIEB-UHFFFAOYSA-O

group of stereoisomers with the chemical formula C₅₃H₅₇O₂₇⁺

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Statements

group of stereoisomers

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1,125.30817298409 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₅₃H₅₇O₂₇⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

O=C(OCC1OC(OC2=CC=3C(OC4OC(CO)C(O)C(O)C4O)=CC(O)=CC3[O+]=C2C=5C=CC(O)=C(O)C5)C(OC6OCC(O)C(O)C6OC(=O)C=CC7=CC(OC)=C(O)C(OC)=C7)C(O)C1O)C=CC8=CC=C(O)C(OC)=C8

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Matthiola incana

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

Identifiers

InChI=1S/C53H56O27/c1-69-33-12-22(4-8-28(33)57)5-10-39(60)72-21-38-44(65)46(67)50(80-52-49(41(62)30(59)20-73-52)79-40(61)11-6-23-13-34(70-2)42(63)35(14-23)71-3)53(78-38)76-36-18-26-31(74-48(36)24-7-9-27(56)29(58)15-24)16-25(55)17-32(26)75-51-47(68)45(66)43(64)37(19-54)77-51/h4-18,30,37-38,41,43-47,49-54,59,62,64-68H,19-21H2,1-3H3,(H4-,55,56,57,58,60,61,63)/p+1

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VYROXVUTZWOIEB-UHFFFAOYSA-O

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2 references

15 September 2022

matched by identifier from

VYROXVUTZWOIEB-UHFFFAOYSA-O

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