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(Q77374450)
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Chaetomugilin J
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
5-chloro-7-hydroxy-7-methyl-8-(3-methyl-2-oxopent-3-enyl)-3-(3-methylpent-1-enyl)-8H-isochromen-6-one
1 reference
based on heuristic
inferred from SMILES
mass
390.159787024
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₇ClO₄
0 references
canonical SMILES
O=C(C(=CC)C)CC1C2=COC(C=CC(C)CC)=CC2=C(Cl)C(=O)C1(O)C
0 references
isomeric SMILES
CC[C@H](C)/C=C/C1=CC2=C(C(=O)[C@@]([C@H](C2=CO1)CC(=O)/C(=C/C)/C)(C)O)Cl
0 references
found in taxon
Chaetomium globosum
3 references
stated in
Determination of the absolute configuration of chaetoviridins and other bioactive azaphilones from the endophytic fungus Chaetomium globosum
stated in
Chaetomugilins I–O, new potent cytotoxic metabolites from a marine-fish-derived Chaetomium species. Stereochemistry and biological activities
stated in
Chaetomugilins I–O, new potent cytotoxic metabolites from a marine-fish-derived Chaetomium species. Stereochemistry and biological activities
flathead mullet
1 reference
stated in
Chaetomugilins I–O, new potent cytotoxic metabolites from a marine-fish-derived Chaetomium species. Stereochemistry and biological activities
Identifiers
InChI
InChI=1S/C22H27ClO4/c1-6-13(3)8-9-15-10-16-17(12-27-15)18(11-19(24)14(4)7-2)22(5,26)21(25)20(16)23/h7-10,12-13,18,26H,6,11H2,1-5H3/b9-8+,14-7+/t13-,18-,22-/m0/s1
0 references
InChIKey
DIBDMIBWFDRKHK-ODXBHRCKSA-N
2 references
stated in
PubChem
PubChem CID
44250065
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
44250065
language of work or name
English
PubChem CID
44250065
2 references
stated in
PubChem
PubChem CID
44250065
language of work or name
English
matched by identifier from
InChIKey
InChIKey
DIBDMIBWFDRKHK-ODXBHRCKSA-N
ChEBI ID
202949
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C22H27ClO4/c1-6-13(3)8-9-15-10-16-17(12-27-15)18(11-19(24)14(4)7-2)22(5,26)21(25)20(16)23/h7-10,12-13,18,26H,6,11H2,1-5H3/b9-8+,14-7+/t13-,18-,22-/m0/s1
UniChem compound ID
32650526
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA005821
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DIBDMIBWFDRKHK-ODXBHRCKSA-N
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