(Q110193726)

English

[(2R)-3-[(1R)-4-formyl-1-hydroxy-8-methyl-10-[(1S,2R)-2-methyl-1-prop-1-en-2-ylcyclopentyl]deca-3,7-dienyl]-5-oxo-2H-furan-2-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

[3-[4-formyl-1-hydroxy-8-methyl-10-(2-methyl-1-prop-1-en-2-ylcyclopentyl)deca-3,7-dienyl]-5-oxo-2H-furan-2-yl] acetate

1 reference

based on heuristic

inferred from SMILES

mass

458.266838936 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(2R)-3-[(1R,3E,7E)-4-formyl-1-hydroxy-8-methyl-10-[(1R,2R)-2-methyl-1-prop-1-en-2-ylcyclopentyl]deca-3,7-dienyl]-5-oxo-2H-furan-2-yl] acetate

1 reference

based on heuristic

inferred from InChI

[(2S)-3-[(1S,3E,7E)-4-formyl-1-hydroxy-8-methyl-10-[(1R,2R)-2-methyl-1-prop-1-en-2-ylcyclopentyl]deca-3,7-dienyl]-5-oxo-2H-furan-2-yl] acetate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₃₈O₆

0 references

canonical SMILES

O=CC(=CCC(O)C1=CC(=O)OC1OC(=O)C)CCC=C(C)CCC2(C(=C)C)CCCC2C

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isomeric SMILES

C=C(C)[C@]1(CCC(C)=CCCC(C=O)=CC[C@@H](O)C2=CC(=O)O[C@H]2OC(C)=O)CCC[C@H]1C

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found in taxon

Luffariella variabilis

1 reference

stated in

ESI FTICR-MS analysis of larvae from the marine sponge Luffariella variabilis

Identifiers

InChI

InChI=1S/C27H38O6/c1-18(2)27(14-7-9-20(27)4)15-13-19(3)8-6-10-22(17-28)11-12-24(30)23-16-25(31)33-26(23)32-21(5)29/h8,11,16-17,20,24,26,30H,1,6-7,9-10,12-15H2,2-5H3/t20-,24-,26-,27-/m1/s1

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InChIKey

RKPLHWCOJKGGMT-RXTZQXTGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RKPLHWCOJKGGMT-RXTZQXTGSA-N

(Q110193726)

[(2R)-3-[(1R)-4-formyl-1-hydroxy-8-methyl-10-[(1S,2R)-2-methyl-1-prop-1-en-2-ylcyclopentyl]deca-3,7-dienyl]-5-oxo-2H-furan-2-yl] acetate

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Identifiers

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