(Q105267180)

English

(2S,3R,4S,5S,6R)-2-[[(1S,4aS,6S,7aS)-6-hydroxy-4-[(S)-hydroxy(methoxy)methyl]-7-methylidene-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

chemical compound

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instance of

type of chemical entity

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subclass of

2-[[6-hydroxy-4-[hydroxy(methoxy)methyl]-7-methylidene-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

390.152597032 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₆O₁₀

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canonical SMILES

OCC1OC(OC2OC=C(C(O)OC)C3CC(O)C(=C)C23)C(O)C(O)C1O

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isomeric SMILES

C=C1[C@@H](O)C[C@@H]2C([C@@H](O)OC)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12

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found in taxon

Aureolaria flava

1 reference

stated in

Iridoid glycosides of Aureolaria flava and their sequestration by Euphydryas phaeton butterflies

Identifiers

InChI

InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5,7,9-23H,1,3-4H2,2H3/t7-,9+,10-,11-,12-,13+,14-,15+,16+,17+/m1/s1

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InChIKey

TXZBXNYXMDKPRV-LDMILEDWSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105267180)

(2S,3R,4S,5S,6R)-2-[[(1S,4aS,6S,7aS)-6-hydroxy-4-[(S)-hydroxy(methoxy)methyl]-7-methylidene-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

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Identifiers

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