(Q105243016)

English

methyl (1R,2S,6S,7S,8S,9E,11R)-8-acetyloxy-11-hydroxy-13-methyl-7-[(E)-2-methylbut-2-enoyl]oxy-5-methylidene-4-oxo-3,14-dioxatricyclo[9.2.1.02,6]tetradeca-9,12-diene-9-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

methyl 8-(acetyloxy)-11-hydroxy-13-methyl-7-[(2-methylbut-2-enoyl)oxy]-5-methylidene-4-oxo-3,14-dioxatricyclo[9.2.1.0²,⁶]tetradeca-9,12-diene-9-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

462.152597032 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

methyl (1R,2S,6S,7S,8S,9E,11R)-8-acetyloxy-11-hydroxy-13-methyl-7-[(Z)-2-methylbut-2-enoyl]oxy-5-methylidene-4-oxo-3,14-dioxatricyclo[9.2.1.02,6]tetradeca-9,12-diene-9-carboxylate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₃H₂₆O₁₀

0 references

canonical SMILES

O=C(OC)C1=CC2(O)OC(C(=C2)C)C3OC(=O)C(=C)C3C(OC(=O)C(=CC)C)C1OC(=O)C

0 references

isomeric SMILES

C=C1C(=O)O[C@H]2[C@H]1[C@H](OC(=O)/C(C)=C/C)[C@@H](OC(C)=O)/C(C(=O)OC)=C\[C@@]1(O)C=C(C)[C@H]2O1

0 references

found in taxon

Ichthyothere terminalis

1 reference

stated in

New melampolides, kaurene derivatives and other constituents from Ichthyothere species

Identifiers

InChI

InChI=1S/C23H26O10/c1-7-10(2)20(25)31-19-15-12(4)21(26)32-18(15)16-11(3)8-23(28,33-16)9-14(22(27)29-6)17(19)30-13(5)24/h7-9,15-19,28H,4H2,1-3,5-6H3/b10-7+,14-9+/t15-,16+,17-,18-,19-,23+/m0/s1

0 references

InChIKey

RPTKZHBJEPAFDD-JSICDYDESA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RPTKZHBJEPAFDD-JSICDYDESA-N

(Q105243016)

methyl (1R,2S,6S,7S,8S,9E,11R)-8-acetyloxy-11-hydroxy-13-methyl-7-[(E)-2-methylbut-2-enoyl]oxy-5-methylidene-4-oxo-3,14-dioxatricyclo[9.2.1.02,6]tetradeca-9,12-diene-9-carboxylate

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Identifiers

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