(Q105350492)

English

[(1S,4aR)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6-tetrahydrocyclopenta[c]pyran-7-yl]methyl acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[1-[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6-tetrahydrocyclopenta[c]pyran-7-yl]methyl acetate

1 reference

based on heuristic

inferred from SMILES

mass

372.142032348 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₄O₉

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canonical SMILES

O=C(OCC1=C2C(OC=CC2CC1)OC3OC(CO)C(O)C(O)C3O)C

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isomeric SMILES

CC(=O)OCC1=C2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C[C@H]2CC1

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found in taxon

Veronica cymbalaria

1 reference

stated in

Iridoid glucosides from Plantago cornuti, Plantago major and Veronica cymbalaria

Identifiers

InChI

InChI=1S/C17H24O9/c1-8(19)24-7-10-3-2-9-4-5-23-16(12(9)10)26-17-15(22)14(21)13(20)11(6-18)25-17/h4-5,9,11,13-18,20-22H,2-3,6-7H2,1H3/t9-,11-,13-,14+,15-,16+,17+/m1/s1

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InChIKey

YMFCKAIEUREIEJ-QRXPNYKFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YMFCKAIEUREIEJ-QRXPNYKFSA-N

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