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(Q77378950)
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Cyclopiamine B
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
7'-Methoxy-8,8,11',11'-tetramethyl-5a-nitrospiro[1,2,3,5,6,8a,9,9a-octahydrocyclopenta[f]indolizine-7,3'-1-azatricyclo[6.3.1.04,12]dodeca-4(12),5,7-triene]-2',9'-dione
1 reference
based on heuristic
inferred from SMILES
mass
467.242021156
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
cyclopiamine a
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Clopiamine C
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₆H₃₃N₃O₅
0 references
canonical SMILES
O=C1C=2C(OC)=CC=C3C2N(C(=O)C34CC5([N+](=O)[O-])CN6CCCC6CC5C4(C)C)C(C)(C)C1
0 references
isomeric SMILES
COc1ccc2c3c1C(=O)CC(C)(C)N3C(=O)[C@@]21C[C@@]2([N+](=O)[O-])CN3CCC[C@@H]3C[C@H]2C1(C)C
0 references
found in taxon
Penicillium aurantiogriseum
3 references
stated in
Griseofulvin Derivative and Indole Alkaloids from Penicillium griseofulvum CPCC 400528.
stated in
Cyclopiamines A and B, novel oxindole metabolites of Penicillium cyclopium westling
stated in
Cyclopiamines A and B, novel oxindole metabolites of Penicillium cyclopium westling
Penicillium cyclopium
3 references
stated in
Griseofulvin Derivative and Indole Alkaloids from Penicillium griseofulvum CPCC 400528.
stated in
Cyclopiamines A and B, novel oxindole metabolites of Penicillium cyclopium westling
stated in
Cyclopiamines A and B, novel oxindole metabolites of Penicillium cyclopium westling
Penicillium
1 reference
stated in
Use of experimental design for the optimization of the production of new secondary metabolites by two Penicillium species.
Identifiers
InChI
InChI=1S/C26H33N3O5/c1-23(2)12-17(30)20-18(34-5)9-8-16-21(20)28(23)22(31)26(16)13-25(29(32)33)14-27-10-6-7-15(27)11-19(25)24(26,3)4/h8-9,15,19H,6-7,10-14H2,1-5H3/t15-,19+,25-,26-/m1/s1
0 references
InChIKey
LUESCPPTDJZZQN-DCWDXPITSA-N
2 references
stated in
PubChem
PubChem CID
11969569
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
11969569
language of work or name
English
CAS Registry Number
72401-58-2
0 references
PubChem CID
11969569
1 reference
stated in
PubChem
PubChem CID
11969569
language of work or name
English
ChEBI ID
203578
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C26H33N3O5/c1-23(2)12-17(30)20-18(34-5)9-8-16-21(20)28(23)22(31)26(16)13-25(29(32)33)14-27-10-6-7-15(27)11-19(25)24(26,3)4/h8-9,15,19H,6-7,10-14H2,1-5H3/t15-,19+,25-,26-/m1/s1
UniChem compound ID
1045075
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50474934
0 references
DSSTOX compound identifier
DTXCID90425748
0 references
NSC number
333065
0 references
UNII
KOK79DO2R2
1 reference
matched by identifier from
InChIKey
InChIKey
LUESCPPTDJZZQN-DCWDXPITSA-N
Natural Product Atlas ID
NPA006547
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LUESCPPTDJZZQN-DCWDXPITSA-N
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