(Q104920391)

English

methyl (Z,7E)-7-[(2S)-2-hydroxy-2-[(Z)-oct-2-enyl]-5-oxocyclopent-3-en-1-ylidene]hept-5-enoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

methyl (5E)-7-[(1E)-2-hydroxy-2-(oct-2-en-1-yl)-5-oxocyclopent-3-en-1-ylidene]hept-5-enoate

1 reference

based on heuristic

inferred from SMILES

methyl 7-[(1E)-2-hydroxy-2-(oct-2-en-1-yl)-5-oxocyclopent-3-en-1-ylidene]hept-5-enoate

1 reference

based on heuristic

inferred from SMILES

Methyl 7-(2-hydroxy-2-oct-2-enyl-5-oxocyclopent-3-en-1-ylidene)hept-5-enoate

1 reference

based on heuristic

inferred from SMILES

mass

346.21440944 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

4-Deacetoxyl-12-O-deacetylclavulone III

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

4-Deacetoxyl-12-O-deacetylclavulone II

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

4-Deacetoxyl-12-O-deacetylclavulone I

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₁H₃₀O₄

0 references

canonical SMILES

O=C1C=CC(O)(C1=CC=CCCCC(=O)OC)CC=CCCCCC

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isomeric SMILES

CCCCC/C=C\C[C@]1(O)C=CC(=O)/C1=C/C=C\CCCC(=O)OC

0 references

found in taxon

Clavularia viridis

1 reference

stated in

New prostanoids with cytotoxic activity from Taiwanese octocoral Clavularia viridis

Identifiers

InChI

InChI=1S/C21H30O4/c1-3-4-5-6-9-12-16-21(24)17-15-19(22)18(21)13-10-7-8-11-14-20(23)25-2/h7,9-10,12-13,15,17,24H,3-6,8,11,14,16H2,1-2H3/b10-7-,12-9-,18-13-/t21-/m0/s1

0 references

InChIKey

AWZZJUDSRONIBA-PNWWPXMXSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

AWZZJUDSRONIBA-PNWWPXMXSA-N

1 reference

(Q104920391)

methyl (Z,7E)-7-[(2S)-2-hydroxy-2-[(Z)-oct-2-enyl]-5-oxocyclopent-3-en-1-ylidene]hept-5-enoate

Statements

Identifiers

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