(Q105004134)

English

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

group of stereoisomers with the chemical formula C₄₅H₇₂O₁₇

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instance of

group of stereoisomers

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1 reference

884.4769508440005 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₅H₇₂O₁₇

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canonical SMILES

OCC1OC(OC2C(O)C(O)C(OC3CC4=CCC5C(CCC6(C)C5CC7OC8(OCC(C)CC8)C(C)C76)C4(C)CC3)OC2CO)C(OC9OC(C)C(O)C(O)C9O)C(O)C1O

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Identifiers

InChI

InChI=1S/C45H72O17/c1-19-8-13-45(55-18-19)20(2)30-27(62-45)15-26-24-7-6-22-14-23(9-11-43(22,4)25(24)10-12-44(26,30)5)57-41-37(54)35(52)38(29(17-47)59-41)60-42-39(34(51)32(49)28(16-46)58-42)61-40-36(53)33(50)31(48)21(3)56-40/h6,19-21,23-42,46-54H,7-18H2,1-5H3

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InChIKey

FXOMQOAAJCQQCO-UHFFFAOYSA-N

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PubChem CID

163028728

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

FXOMQOAAJCQQCO-UHFFFAOYSA-N

KNApSAcK ID

C00054911

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

FXOMQOAAJCQQCO-UHFFFAOYSA-N

(Q105004134)

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

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