(Q105345118)

English

1-[(1E,3S)-3-(beta-D-Glucopyranosyloxy)-1-butenyl]-2,6,6-trimethylcyclohexane-1alpha,2beta,4alpha-triol

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

2-(Hydroxymethyl)-6-[4-(1,2,4-trihydroxy-2,6,6-trimethylcyclohexyl)but-3-en-2-yloxy]oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

406.220282668 dalton

1 reference

1 reference

1 reference

(3S,5R,6R,7E,9S)-Megastigman-7-ene-3,5,6,9-tetrol 9-O-beta-D-glucopyranoside

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C₁₉H₃₄O₉

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canonical SMILES

OCC1OC(OC(C=CC2(O)C(O)(C)CC(O)CC2(C)C)C)C(O)C(O)C1O

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isomeric SMILES

C[C@@H](/C=C/[C@]1(O)C(C)(C)C[C@@H](O)C[C@]1(C)O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

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found in taxon

Crataegus pinnatifida

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stated in

Terpenoids and hexenes from the leaves of Crataegus pinnatifida.

Tetradium glabrifolium

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stated in

Euodionosides A-G: megastigmane glucosides from leaves of Euodia meliaefolia

Identifiers

InChI

InChI=1S/C19H34O9/c1-10(27-16-15(24)14(23)13(22)12(9-20)28-16)5-6-19(26)17(2,3)7-11(21)8-18(19,4)25/h5-6,10-16,20-26H,7-9H2,1-4H3/b6-5+/t10-,11+,12+,13+,14-,15+,16+,18-,19-/m0/s1

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InChIKey

XZRJEYQBLXDNNU-BFFMHGNPSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XZRJEYQBLXDNNU-BFFMHGNPSA-N

1 reference

(Q105345118)

1-[(1E,3S)-3-(beta-D-Glucopyranosyloxy)-1-butenyl]-2,6,6-trimethylcyclohexane-1alpha,2beta,4alpha-triol

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Identifiers

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