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(Q77625432)
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English
F1839-E
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
2,3,4'-trihydroxy-7'-(2-hydroxyethyl)-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-6'-one
1 reference
based on heuristic
inferred from SMILES
mass
445.24643784
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(2R,3S,4aS,7S,8R,8aS)-2,3,4'-trihydroxy-7'-(2-hydroxyethyl)-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-6'-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₅H₃₅NO₆
0 references
canonical SMILES
O=C1C2=CC(O)=C3C(OC4(C3)C(C)CCC5C(C)(C)C(O)C(O)CC54C)=C2CN1CCO
0 references
isomeric SMILES
C[C@@H]1CC[C@@H]2[C@@]([C@@]13CC4=C(C=C5C(=C4O3)CN(C5=O)CCO)O)(C[C@H]([C@H](C2(C)C)O)O)C
0 references
found in taxon
Stachybotrys
1 reference
stated in
Isolation, characterization and biological activities of novel triprenyl phenols as pancreatic cholesterol esterase inhibitors produced by Stachybotrys sp. F-1839
Stachybotrys chartarum
1 reference
stated in
Chartarlactams A–P, Phenylspirodrimanes from the Sponge-Associated Fungus Stachybotrys chartarum with Antihyperlipidemic Activities
Identifiers
InChI
InChI=1S/C25H35NO6/c1-13-5-6-19-23(2,3)21(30)18(29)11-24(19,4)25(13)10-15-17(28)9-14-16(20(15)32-25)12-26(7-8-27)22(14)31/h9,13,18-19,21,27-30H,5-8,10-12H2,1-4H3/t13-,18-,19+,21-,24+,25-/m1/s1
0 references
InChIKey
PAILZINGRRXKCY-RNIWIPBASA-N
2 references
stated in
PubChem
PubChem CID
10026548
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
10026548
language of work or name
English
PubChem CID
10026548
2 references
stated in
PubChem
PubChem CID
10026548
language of work or name
English
matched by identifier from
InChIKey
InChIKey
PAILZINGRRXKCY-RNIWIPBASA-N
ChEBI ID
225603
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C25H35NO6/c1-13-5-6-19-23(2,3)21(30)18(29)11-24(19,4)25(13)10-15-17(28)9-14-16(20(15)32-25)12-26(7-8-27)22(14)31/h9,13,18-19,21,27-30H,5-8,10-12H2,1-4H3/t13-,18-,19+,21-,24+,25-/m1/s1
UniChem compound ID
32036336
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA017101
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PAILZINGRRXKCY-RNIWIPBASA-N
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