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(Q77513324)
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English
11-O-methylpseurotin A
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
tetramic acid
0 references
mass
445.173666824
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(5S,8S,9R)-8-benzoyl-9-hydroxy-2-[(1S,2S)-1-hydroxy-2-methoxyhex-3-enyl]-8-methoxy-3-methyl-1-oxa-7-azaspiro[4.4]non-2-ene-4,6-dione
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₃H₂₇NO₈
0 references
canonical SMILES
CCC=CC(OC)C(O)C1=C(C)C(=O)C2(O1)C(=O)NC(OC)(C(=O)c1ccccc1)C2O
0 references
isomeric SMILES
CC/C=C\[C@@H]([C@@H](C1=C(C(=O)[C@@]2(O1)[C@H]([C@@](NC2=O)(C(=O)C3=CC=CC=C3)OC)O)C)O)OC
0 references
found in taxon
Aspergillus fumigatus
1 reference
stated in
Pinpointing pseurotins from a marine-derived Aspergillus as tools for chemical genetics using a synthetic lethality yeast screen
Aspergillus sulphureus
1 reference
stated in
Prenylated indole alkaloids from co-culture of marine-derived fungi Aspergillus sulphureus and Isaria felina
Beauveria felina
1 reference
stated in
Prenylated indole alkaloids from co-culture of marine-derived fungi Aspergillus sulphureus and Isaria felina
Identifiers
InChI
InChI=1S/C23H27NO8/c1-5-6-12-15(30-3)16(25)17-13(2)18(26)22(32-17)20(28)23(31-4,24-21(22)29)19(27)14-10-8-7-9-11-14/h6-12,15-16,20,25,28H,5H2,1-4H3,(H,24,29)/b12-6-/t15-,16-,20+,22+,23+/m0/s1
0 references
InChIKey
BSXLPZRKEPWAAT-CHZVKGAWSA-N
2 references
stated in
PubChem
PubChem CID
23656807
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
23656807
language of work or name
English
PubChem CID
23656807
2 references
stated in
PubChem
PubChem CID
23656807
language of work or name
English
matched by identifier from
InChIKey
InChIKey
BSXLPZRKEPWAAT-CHZVKGAWSA-N
ChEBI ID
227338
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C23H27NO8/c1-5-6-12-15(30-3)16(25)17-13(2)18(26)22(32-17)20(28)23(31-4,24-21(22)29)19(27)14-10-8-7-9-11-14/h6-12,15-16,20,25,28H,5H2,1-4H3,(H,24,29)/b12-6-/t15-,16-,20+,22+,23+/m0/s1
UniChem compound ID
258461
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA013127
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BSXLPZRKEPWAAT-CHZVKGAWSA-N
Probes And Drugs ID
PD117246
0 references
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