(Q105132406)

English

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4S)-4-(2-hydroxypropan-2-yl)cyclohexene-1-carbonyl]oxyoxan-2-yl]methyl (4S)-4-(2-hydroxypropan-2-yl)cyclohexene-1-carboxylate

chemical compound

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1 reference

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carbonyloxy]oxan-2-yl]methyl 4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

512.26214748 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4R)-4-(2-hydroxypropan-2-yl)cyclohexene-1-carbonyl]oxyoxan-2-yl]methyl (4S)-4-(2-hydroxypropan-2-yl)cyclohexene-1-carboxylate

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₆H₄₀O₁₀

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canonical SMILES

O=C(OCC1OC(OC(=O)C2=CCC(CC2)C(O)(C)C)C(O)C(O)C1O)C3=CCC(CC3)C(O)(C)C

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isomeric SMILES

CC(C)(O)[C@@H]1CC=C(C(=O)OC[C@H]2O[C@@H](OC(=O)C3=CC[C@@H](C(C)(C)O)CC3)[C@H](O)[C@@H](O)[C@@H]2O)CC1

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found in taxon

Eucalyptus globulus

2 references

stated in

Bioactive monoterpene glycosides conjugated with gallic acid from the leaves of Eucalyptus globulus

stated in

Bioactive monoterpene glycosides conjugated with gallic acid from the leaves of Eucalyptus globulus

Identifiers

InChI

InChI=1S/C26H40O10/c1-25(2,32)16-9-5-14(6-10-16)22(30)34-13-18-19(27)20(28)21(29)24(35-18)36-23(31)15-7-11-17(12-8-15)26(3,4)33/h5,7,16-21,24,27-29,32-33H,6,8-13H2,1-4H3/t16-,17-,18-,19-,20+,21-,24+/m1/s1

0 references

InChIKey

JOLLIDAUJSAZHE-DBNCLBANSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105132406)

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4S)-4-(2-hydroxypropan-2-yl)cyclohexene-1-carbonyl]oxyoxan-2-yl]methyl (4S)-4-(2-hydroxypropan-2-yl)cyclohexene-1-carboxylate

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