(Q105343861)

English

2-[4,5-Dihydroxy-2-[[6-hydroxy-10-(hydroxymethyl)-8,14-dimethyl-7-(2-methylprop-1-enyl)-5-oxapentacyclo[11.8.0.02,10.04,9.014,19]henicos-19-en-17-yl]oxy]-6-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol

group of stereoisomers with the chemical formula C₃₉H₆₂O₁₃

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

738.419042044 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₉H₆₂O₁₃

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canonical SMILES

OCC1OC(OC2CC3=CCC4C(CCC5(CO)C4CC6OC(O)C(C=C(C)C)C(C)C65)C3(C)CC2)C(OC7OC(C)C(O)C(O)C7O)C(O)C1O

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Identifiers

InChI

InChI=1S/C39H62O13/c1-17(2)12-23-18(3)28-26(50-35(23)47)14-25-22-7-6-20-13-21(8-10-38(20,5)24(22)9-11-39(25,28)16-41)49-37-34(32(45)30(43)27(15-40)51-37)52-36-33(46)31(44)29(42)19(4)48-36/h6,12,18-19,21-37,40-47H,7-11,13-16H2,1-5H3

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InChIKey

XWXNYTAZSRQKID-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XWXNYTAZSRQKID-UHFFFAOYSA-N

(Q105343861)

2-[4,5-Dihydroxy-2-[[6-hydroxy-10-(hydroxymethyl)-8,14-dimethyl-7-(2-methylprop-1-enyl)-5-oxapentacyclo[11.8.0.02,10.04,9.014,19]henicos-19-en-17-yl]oxy]-6-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol

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