(Q104917576)

English

[(1S,3R,8S,9S,10R,11S,13R)-11-acetyloxy-3-hydroxy-6,9,10-trimethyl-5-oxo-4,14-dioxatetracyclo[7.5.0.01,13.03,7]tetradec-6-en-8-yl] 2-methylpropanoate

chemical compound

In more languages

Statements

type of chemical entity

0 references

(11-Acetyloxy-3-hydroxy-6,9,10-trimethyl-5-oxo-4,14-dioxatetracyclo[7.5.0.01,13.03,7]tetradec-6-en-8-yl) 2-methylpropanoate

1 reference

based on heuristic

inferred from SMILES

408.178417856 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₈O₈

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canonical SMILES

O=C1OC2(O)C(=C1C)C(OC(=O)C(C)C)C3(C)C(C)C(OC(=O)C)CC4OC43C2

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isomeric SMILES

CC(=O)O[C@H]1C[C@H]2O[C@]23C[C@@]2(O)OC(=O)C(C)=C2[C@@H](OC(=O)C(C)C)[C@]3(C)[C@H]1C

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Pittocaulon praecox

1 reference

Eremophilane Derivatives from Pittocaulon praecox

Identifiers

InChI=1S/C21H28O8/c1-9(2)17(23)27-16-15-10(3)18(24)29-21(15,25)8-20-14(28-20)7-13(26-12(5)22)11(4)19(16,20)6/h9,11,13-14,16,25H,7-8H2,1-6H3/t11-,13-,14+,16+,19-,20+,21+/m0/s1

0 references

ARUFRASKALWZFE-XYZPGSSUSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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