(Q105348374)

English

(1S,2S,3R,6S,7S,9R,13R,17S)-3,4,15-trimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-11,16-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

1alpha-O-Methylquassin

1 reference

based on heuristic

inferred from SMILES

mass

404.219888744 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₃₂O₆

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canonical SMILES

O=C1OC2CC3C(C=C(OC)C(OC)C3(C)C4C(=O)C(OC)=C(C)C(C1)C24C)C

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isomeric SMILES

COC1=C[C@@H](C)[C@@H]2C[C@H]3OC(=O)C[C@H]4C(C)=C(OC)C(=O)[C@H]([C@@]2(C)[C@H]1OC)[C@@]34C

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found in taxon

Quassia amara

1 reference

stated in

Quassinoids from Quassia amara

Identifiers

InChI

InChI=1S/C23H32O6/c1-11-8-15(26-5)21(28-7)23(4)13(11)9-16-22(3)14(10-17(24)29-16)12(2)19(27-6)18(25)20(22)23/h8,11,13-14,16,20-21H,9-10H2,1-7H3/t11-,13+,14+,16-,20+,21+,22-,23+/m1/s1

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InChIKey

YHEQIRIWAKHQFI-LLXMQESCSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YHEQIRIWAKHQFI-LLXMQESCSA-N

1 reference

(Q105348374)

(1S,2S,3R,6S,7S,9R,13R,17S)-3,4,15-trimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-11,16-dione

Statements

Identifiers

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