(Q105264757)

English

(3S)-3-hydroxy-2,2,5,7-tetramethyl-6-[2-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

illudalane sesquiterpenoid

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mass

410.19406792 dalton

1 reference

1 reference

C₂₁H₃₀O₈

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canonical SMILES

O=C1C2=C(C(=C(C=C2C(O)C1(C)C)C)CCOC3OC(CO)C(O)C(O)C3O)C

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isomeric SMILES

Cc1cc2c(c(C)c1CCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)C(=O)C(C)(C)[C@H]2O

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found in taxon

Pteridium aquilinum

1 reference

stated in

Structure of Pteroside Z and D, Glycosides of Pteridium aquilinum var. latiusculum

Identifiers

InChI

InChI=1S/C21H30O8/c1-9-7-12-14(19(27)21(3,4)18(12)26)10(2)11(9)5-6-28-20-17(25)16(24)15(23)13(8-22)29-20/h7,13,15-18,20,22-26H,5-6,8H2,1-4H3/t13-,15-,16+,17+,18+,20-/m1/s1

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InChIKey

TUGWHBZURNWRDG-XNNUGQPQSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

TUGWHBZURNWRDG-XNNUGQPQSA-N

(Q105264757)

(3S)-3-hydroxy-2,2,5,7-tetramethyl-6-[2-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one

Statements

Identifiers

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