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(Q75055015)
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Stachybotrin A
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
farnesane sesquiterpenoid
0 references
isoindole alkaloid
0 references
mass
401.220223092
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₃₁NO₅
0 references
canonical SMILES
CC(C)=CCCC(=CCCC1(C)Oc2c(c(O)cc3c2CNC3=O)CC1O)CO
0 references
isomeric SMILES
CC(C)=CCC/C(=C\CC[C@]1(C)Oc2c(c(O)cc3c2CNC3=O)C[C@@H]1O)CO
0 references
found in taxon
Stachybotrys
1 reference
stated in
Stachybotrins A and B: novel bioactive metabolites from a brackish water isolate of the fungus Stachybotrys sp
Stachybotrys alternans
1 reference
stated in
Low-molecular-mass metabolites of fungi iV. The structures of stachybotrin a and stachybotral
Identifiers
InChI
InChI=1S/C23H31NO5/c1-14(2)6-4-7-15(13-25)8-5-9-23(3)20(27)11-17-19(26)10-16-18(21(17)29-23)12-24-22(16)28/h6,8,10,20,25-27H,4-5,7,9,11-13H2,1-3H3,(H,24,28)/b15-8+/t20-,23-/m0/s1
0 references
InChIKey
ZVZKOARXMVUPBB-KWOFNGTCSA-N
0 references
PubChem CID
132472759
2 references
stated in
PubChem
PubChem CID
132472759
language of work or name
English
matched by identifier from
InChIKey
InChIKey
ZVZKOARXMVUPBB-KWOFNGTCSA-N
ChEBI ID
197746
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C23H31NO5/c1-14(2)6-4-7-15(13-25)8-5-9-23(3)20(27)11-17-19(26)10-16-18(21(17)29-23)12-24-22(16)28/h6,8,10,20,25-27H,4-5,7,9,11-13H2,1-3H3,(H,24,28)/b15-8+/t20-,23-/m0/s1
UniChem compound ID
164460141
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA000237
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZVZKOARXMVUPBB-KWOFNGTCSA-N
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