(Q105253061)

English

2-[6-(2,4'-Dihydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl)oxy-4-hydroxy-2-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol

group of stereoisomers with the chemical formula C₄₅H₇₂O₁₈

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instance of

group of stereoisomers

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1 reference

900.4718654640005 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₅H₇₂O₁₈

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canonical SMILES

OCC1OC(OC2CC3=CCC4C(CCC5(C)C6C(OC7(OCC(C)C(O)C7)C6C)CC45O)C3(C)CC2)C(OC8OC(C)C(O)C(O)C8O)C(O)C1OC9OC(C)C(O)C(O)C9O

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Identifiers

InChI

InChI=1S/C45H72O18/c1-18-17-56-45(14-26(18)47)19(2)29-27(63-45)15-44(55)25-8-7-22-13-23(9-11-42(22,5)24(25)10-12-43(29,44)6)59-41-38(62-40-35(53)33(51)31(49)21(4)58-40)36(54)37(28(16-46)60-41)61-39-34(52)32(50)30(48)20(3)57-39/h7,18-21,23-41,46-55H,8-17H2,1-6H3

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InChIKey

SHMHKBDXIIVQMO-UHFFFAOYSA-N

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PubChem CID

163011732

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

SHMHKBDXIIVQMO-UHFFFAOYSA-N

(Q105253061)

2-[6-(2,4'-Dihydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl)oxy-4-hydroxy-2-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol

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