(Q104973667)

English

ethyl 2-[(1R,2R)-3-oxo-2-[(Z)-5-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-2-enyl]cyclopentyl]acetate

chemical compound

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instance of

type of chemical entity

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subclass of

Ethyl 2-[3-oxo-2-[5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-2-enyl]cyclopentyl]acetate

1 reference

based on heuristic

inferred from SMILES

mass

416.204632604 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₂O₉

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canonical SMILES

O=C(OCC)CC1CCC(=O)C1CC=CCCOC2OC(CO)C(O)C(O)C2O

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isomeric SMILES

CCOC(=O)C[C@H]1CCC(=O)[C@@H]1C/C=C\CCO[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O

0 references

found in taxon

Salvia officinalis

1 reference

stated in

Isolation and structural elucidation of two new glycosides from sage (Salvia officinalis L.)

Identifiers

InChI

InChI=1S/C20H32O9/c1-2-27-16(23)10-12-7-8-14(22)13(12)6-4-3-5-9-28-20-19(26)18(25)17(24)15(11-21)29-20/h3-4,12-13,15,17-21,24-26H,2,5-11H2,1H3/b4-3-/t12-,13-,15+,17+,18-,19+,20+/m1/s1

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InChIKey

DALGUVBWVCFIPV-KUJROFIGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DALGUVBWVCFIPV-KUJROFIGSA-N

(Q104973667)

ethyl 2-[(1R,2R)-3-oxo-2-[(Z)-5-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-2-enyl]cyclopentyl]acetate

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