(Q104994204)

English

methyl (2E,6R)-2-(hydroxymethyl)-6-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyocta-2,7-dienoate

chemical compound

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instance of

type of chemical entity

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subclass of

Methyl 2-(hydroxymethyl)-6-methyl-6-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyocta-2,7-dienoate

1 reference

based on heuristic

inferred from SMILES

mass

360.178417856 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

methyl (2E,6S)-2-(hydroxymethyl)-6-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyocta-2,7-dienoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₈O₈

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canonical SMILES

O=C(OC)C(=CCCC(OC1OC(C)C(O)C(O)C1O)(C=C)C)CO

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isomeric SMILES

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

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found in taxon

Elelea concinna

1 reference

stated in

Acacia concinna Saponins. II. Structures of Monoterpenoid Glycosides in the Alkaline Hydrolysate of the Saponin Fraction.

Senegalia pennata

1 reference

stated in

Acacia concinna Saponins. II. Structures of Monoterpenoid Glycosides in the Alkaline Hydrolysate of the Saponin Fraction.

Senegalia rugata

1 reference

stated in

Acacia concinna Saponins. II. Structures of Monoterpenoid Glycosides in the Alkaline Hydrolysate of the Saponin Fraction.

Identifiers

InChI

InChI=1S/C17H28O8/c1-5-17(3,8-6-7-11(9-18)15(22)23-4)25-16-14(21)13(20)12(19)10(2)24-16/h5,7,10,12-14,16,18-21H,1,6,8-9H2,2-4H3/b11-7+/t10-,12-,13+,14-,16+,17+/m1/s1

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InChIKey

FEUOJOODDPASMF-BMMCSTAGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FEUOJOODDPASMF-BMMCSTAGSA-N

1 reference

(Q104994204)

methyl (2E,6R)-2-(hydroxymethyl)-6-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyocta-2,7-dienoate

Statements

Identifiers

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