(Q104964013)

English

2-[4-Hydroxy-6-(hydroxymethyl)-2-(10-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl)oxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol

group of stereoisomers with the chemical formula C₄₅H₇₄O₁₈

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instance of

group of stereoisomers

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1 reference

902.4875155280006 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₅H₇₄O₁₈

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canonical SMILES

OCC1OC(OC2C(O)C(OC3OC(C)C(O)C(O)C3O)C(OC4CCC5(C)C(CCC6C5CC(O)C7(C)C6CC8OC9(OCC(C)CC9)C(C)C87)C4)OC2CO)C(O)C(O)C1O

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Identifiers

InChI

InChI=1S/C45H74O18/c1-18-8-11-45(56-17-18)19(2)30-26(63-45)13-25-23-7-6-21-12-22(9-10-43(21,4)24(23)14-29(48)44(25,30)5)58-42-39(62-40-35(53)33(51)31(49)20(3)57-40)37(55)38(28(16-47)60-42)61-41-36(54)34(52)32(50)27(15-46)59-41/h18-42,46-55H,6-17H2,1-5H3

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InChIKey

CLVVLSJGUOLUNX-UHFFFAOYSA-N

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PubChem CID

73204071

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

CLVVLSJGUOLUNX-UHFFFAOYSA-N

(Q104964013)

2-[4-Hydroxy-6-(hydroxymethyl)-2-(10-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl)oxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol

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