(Q104252972)

English

Isocentratherin

chemical compound

In more languages

Statements

type of chemical entity

0 references

(3-Hydroxy-11-methyl-2,7-dimethylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-1(13)-en-9-yl) 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

374.136553044 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(3R,4S,8R,9R,11R)-3-hydroxy-11-methyl-2,7-dimethylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-1(13)-en-9-yl] (Z)-2-methylbut-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

[(3R,4S,8R,9S,11R)-3-hydroxy-11-methyl-2,7-dimethylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-1(13)-en-9-yl] (E)-2-methylbut-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

5-Epi-Isocentratherin

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₂O₇

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canonical SMILES

O=C1OC2C(O)C(=C)C=3OC(C(=O)C3)(C)CC(OC(=O)C(=CC)C)C2C1=C

0 references

isomeric SMILES

C=C1C2=CC(=O)[C@@](C)(C[C@H](OC(=O)/C(C)=C\C)[C@H]3C(=C)C(=O)O[C@@H]3[C@@H]1O)O2

0 references

Centratherum punctatum

5 references

Further Sesquiterpene Lactones fromElephantopus mollisandCentratherum punctatum

Isocentratherin, a cytotoxic germacranolide from Centratherum punctatum (compositae)

Isocentratherin, a cytotoxic germacranolide from Centratherum punctatum (compositae)

Goyazensolides and isogoyazensolides from Argentine Centratherum punctatum ssp. punctatum

Synergistic properties of sesquiterpene lactones isolated from Centratherum punctatum Cass. in combination with ampicillin against beta-lactam-resistant Gram-negative bacteria

Koyamasia calcarea

1 reference

Antiplasmodial, antimycobacterial, and cytotoxic principles from Camchaya calcarea.

Hololepis pedunculata

1 reference

Constituents of Hololepis pedunculata leaves and their trypanocidal activity

Identifiers

InChI=1S/C20H22O7/c1-6-9(2)18(23)25-13-8-20(5)14(21)7-12(27-20)10(3)16(22)17-15(13)11(4)19(24)26-17/h6-7,13,15-17,22H,3-4,8H2,1-2,5H3/b9-6-/t13-,15+,16+,17-,20+/m0/s1

0 references

LEMMNOMGQFFVKL-LFPYARDOSA-N

0 references

2 references

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

LEMMNOMGQFFVKL-LFPYARDOSA-N

UniChem compound ID

1 reference

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