(Q110079430)

English

10-[4,5-Dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-19-hydroxy-4,5,9,9,13,19,20-heptamethyl-21-oxahexacyclo[18.2.2.01,18.04,17.05,14.08,13]tetracosa-15,17-dien-22-one

group of stereoisomers with the chemical formula C₄₂H₆₄O₁₃

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

776.434692108 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₂H₆₄O₁₃

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canonical SMILES

O=C1OC2(C)CCC13C(=C4C=CC5C6(C)CCC(OC7OC(CO)C(O)C(O)C7OC8OC(C)C(O)C(O)C8O)C(C)(C)C6CCC5(C)C4(C)CC3)C2(O)C

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found in taxon

Ilex kaushue

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stated in

Latifolosides K and L, two new triterpenoid saponins from the bark of Llex latifolia

Ilex kudingcha

1 reference

stated in

Latifolosides K and L, two new triterpenoid saponins from the bark of Llex latifolia

Identifiers

InChI

InChI=1S/C42H64O13/c1-20-26(44)28(46)30(48)33(51-20)54-31-29(47)27(45)22(19-43)52-34(31)53-25-12-13-37(4)23(36(25,2)3)11-14-39(6)24(37)10-9-21-32-41(8,50)40(7)16-18-42(32,35(49)55-40)17-15-38(21,39)5/h9-10,20,22-31,33-34,43-48,50H,11-19H2,1-8H3

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InChIKey

HUXPVJXIFQCKMO-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HUXPVJXIFQCKMO-UHFFFAOYSA-N

(Q110079430)

10-[4,5-Dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-19-hydroxy-4,5,9,9,13,19,20-heptamethyl-21-oxahexacyclo[18.2.2.01,18.04,17.05,14.08,13]tetracosa-15,17-dien-22-one

Statements

Identifiers

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