(Q105346566)

English

2-[4,5-Dihydroxy-2-[[16-hydroxy-7,9,13-trimethyl-6-[3-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]but-3-enyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,18-dien-14-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol

group of stereoisomers with the chemical formula C₄₄H₆₈O₁₇

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instance of

group of stereoisomers

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1 reference

868.4456507160005 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₄H₆₈O₁₇

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canonical SMILES

OCC1OC(OCC(=C)CCC=2OC3CC4C5CC=C6CC(O)CC(OC7OCC(O)C(O)C7OC8OC(C)C(O)C(O)C8O)C6(C)C5CCC4(C)C3C2C)C(O)C(O)C1O

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Identifiers

InChI

InChI=1S/C44H68O17/c1-18(16-55-40-37(53)36(52)34(50)29(15-45)59-40)6-9-27-19(2)31-28(58-27)14-25-23-8-7-21-12-22(46)13-30(44(21,5)24(23)10-11-43(25,31)4)60-42-39(33(49)26(47)17-56-42)61-41-38(54)35(51)32(48)20(3)57-41/h7,20,22-26,28-42,45-54H,1,6,8-17H2,2-5H3

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InChIKey

YCXHBSHHBWHZKV-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YCXHBSHHBWHZKV-UHFFFAOYSA-N

(Q105346566)

2-[4,5-Dihydroxy-2-[[16-hydroxy-7,9,13-trimethyl-6-[3-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]but-3-enyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,18-dien-14-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol

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