(Q115972519)

English

[(1S,2S,6S,7S,9R,13S,14R,15S,16S,17S)-4,15-dimethoxy-2,6,14,17-tetramethyl-3,11-dioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-16-yl] 7-methoxy-1,3-benzodioxole-5-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

570.246497416 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₃₈O₁₀

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canonical SMILES

O=C(OC1C(OC)C(C)C2CC(=O)OC3CC4C(C=C(OC)C(=O)C4(C)C1C32C)C)C5=CC(OC)=C6OCOC6=C5

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isomeric SMILES

COC1=C[C@@H](C)[C@@H]2C[C@H]3OC(=O)C[C@H]4[C@@H](C)[C@H](OC)[C@@H](OC(=O)c5cc(OC)c6c(c5)OCO6)[C@H]([C@@]2(C)C1=O)[C@@]34C

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found in taxon

Picrasma quassioides

1 reference

stated in

Quassinoids from Picrasma quassioides and Their Neuroprotective Effects

Identifiers

InChI

InChI=1S/C31H38O10/c1-14-8-21(36-6)28(33)31(4)17(14)11-22-30(3)18(12-23(32)40-22)15(2)24(37-7)26(27(30)31)41-29(34)16-9-19(35-5)25-20(10-16)38-13-39-25/h8-10,14-15,17-18,22,24,26-27H,11-13H2,1-7H3/t14-,15-,17+,18+,22-,24+,26-,27+,30-,31+/m1/s1

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InChIKey

DNXLSRJAZPXDEW-AUMDUIGHSA-N

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2 references

3 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

DNXLSRJAZPXDEW-AUMDUIGHSA-N

1 reference

(Q115972519)

[(1S,2S,6S,7S,9R,13S,14R,15S,16S,17S)-4,15-dimethoxy-2,6,14,17-tetramethyl-3,11-dioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-16-yl] 7-methoxy-1,3-benzodioxole-5-carboxylate

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Identifiers

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