(Q105125034)

English

[(1S,6S,7R,7aS)-6-acetyloxy-7-(acetyloxymethyl)-7-hydroxy-1-(3-methylbutanoyloxy)-6,7a-dihydro-1H-cyclopenta[c]pyran-4-yl]methyl 3-methylbutanoate

chemical compound

In more languages

Statements

type of chemical entity

0 references

[6-(acetyloxy)-7-[(acetyloxy)methyl]-7-hydroxy-1-[(3-methylbutanoyl)oxy]-1H,6H,7aH-cyclopenta[c]pyran-4-yl]methyl 3-methylbutanoate

1 reference

based on heuristic

inferred from SMILES

482.215197288 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₃₄O₁₀

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canonical SMILES

O=C(OCC1(O)C(OC(=O)C)C=C2C(=COC(OC(=O)CC(C)C)C21)COC(=O)CC(C)C)C

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isomeric SMILES

CC(=O)OC[C@@]1(O)[C@@H](OC(C)=O)C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]21

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Patrinia rupestris

1 reference

Chemical Constituents from the Roots ofPatrinia Rupestris

Identifiers

InChI=1S/C24H34O10/c1-13(2)7-20(27)30-10-17-11-31-23(34-21(28)8-14(3)4)22-18(17)9-19(33-16(6)26)24(22,29)12-32-15(5)25/h9,11,13-14,19,22-23,29H,7-8,10,12H2,1-6H3/t19-,22+,23-,24+/m0/s1

0 references

JCQNBCPVSOEFPG-GMHONNGPSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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