(Q105271909)

English

UFKHJTCACUOKON-UHFFFAOYSA-N

group of stereoisomers with the chemical formula C₆₈H₅₂O₄₂

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Statements

group of stereoisomers

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chemical compound

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1,540.193315704 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₆₈H₅₂O₄₂

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canonical SMILES

O=C(OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C(OC(=O)C4=CC(O)=C(O)C(O)=C4)C1OC(=O)C5=CC(O)=C(O)C(O)=C5OC=6C=C7C(=O)OCC8OC(OC(=O)C9=CC(O)=C(O)C(O)=C9)CCC8OC(=O)C=%10C=C(O)C(O)=C(O)C%10C7=C(O)C6O)C%11=CC(O)=C(O)C(O)=C%11

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Identifiers

InChI=1S/C68H52O42/c69-26-3-18(4-27(70)45(26)81)60(92)100-17-41-57(58(108-62(94)20-7-30(73)47(83)31(74)8-20)59(109-63(95)21-9-32(75)48(84)33(76)10-21)68(105-41)110-64(96)22-11-34(77)49(85)35(78)12-22)107-67(99)25-14-37(80)51(87)55(91)56(25)103-39-15-24-44(54(90)52(39)88)43-23(13-36(79)50(86)53(43)89)66(98)104-38-1-2-42(102-40(38)16-101-65(24)97)106-61(93)19-5-28(71)46(82)29(72)6-19/h3-15,38,40-42,57-59,68-91H,1-2,16-17H2

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UFKHJTCACUOKON-UHFFFAOYSA-N

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2 references

15 September 2022

matched by identifier from

UFKHJTCACUOKON-UHFFFAOYSA-N

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