(Q105184045)

English

methyl 1,5-diacetyloxy-4a,6-dihydroxy-4,4,11b-trimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-7-carboxylate

group of stereoisomers with the chemical formula C₂₅H₃₄O₉

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Statements

instance of

group of stereoisomers

0 references

1 reference

478.220282668 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₃₄O₉

0 references

canonical SMILES

O=C(OC1CCC(C)(C)C2(O)C(OC(=O)C)C(O)C3C(C(=O)OC)C=4C=COC4CC3C12C)C

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found in taxon

Caesalpinia bonducella

1 reference

stated in

Bonducellpins A−D, New Cassane Furanoditerpenes ofCaesalpinia bonduc

Identifiers

InChI

InChI=1S/C25H34O9/c1-12(26)33-17-7-9-23(3,4)25(30)21(34-13(2)27)20(28)19-15(24(17,25)5)11-16-14(8-10-32-16)18(19)22(29)31-6/h8,10,15,17-21,28,30H,7,9,11H2,1-6H3

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InChIKey

NQRAYTDNIQRCFX-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NQRAYTDNIQRCFX-UHFFFAOYSA-N

(Q105184045)

methyl 1,5-diacetyloxy-4a,6-dihydroxy-4,4,11b-trimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-7-carboxylate

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Identifiers

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