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(Q77375481)
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English
Cyclomarazine B
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic cyclopeptide
0 references
biogenic 2,5-diketopiperazine
0 references
mass
383.220891788
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₉N₃O₃
0 references
canonical SMILES
C=CC(C)(C)n1cc(CC2NC(=O)C(CC(C)CO)NC2=O)c2ccccc21
0 references
isomeric SMILES
C[C@H](C[C@H]1C(=O)N[C@H](C(=O)N1)CC2=CN(C3=CC=CC=C32)C(C)(C)C=C)CO
0 references
found in taxon
Salinispora arenicola
1 reference
stated in
Biosynthesis and structures of cyclomarins and cyclomarazines, prenylated cyclic peptides of marine actinobacterial origin.
Identifiers
InChI
InChI=1S/C22H29N3O3/c1-5-22(3,4)25-12-15(16-8-6-7-9-19(16)25)11-18-21(28)23-17(20(27)24-18)10-14(2)13-26/h5-9,12,14,17-18,26H,1,10-11,13H2,2-4H3,(H,23,28)(H,24,27)/t14-,17+,18+/m1/s1
0 references
InChIKey
RDOMJBDZWXNXPA-JLSDUUJJSA-N
2 references
stated in
PubChem
PubChem CID
25220881
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
25220881
language of work or name
English
PubChem CID
25220881
2 references
stated in
PubChem
PubChem CID
25220881
language of work or name
English
matched by identifier from
InChIKey
InChIKey
RDOMJBDZWXNXPA-JLSDUUJJSA-N
ChEBI ID
203114
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C22H29N3O3/c1-5-22(3,4)25-12-15(16-8-6-7-9-19(16)25)11-18-21(28)23-17(20(27)24-18)10-14(2)13-26/h5-9,12,14,17-18,26H,1,10-11,13H2,2-4H3,(H,23,28)(H,24,27)/t14-,17+,18+/m1/s1
UniChem compound ID
55109919
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA006016
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RDOMJBDZWXNXPA-JLSDUUJJSA-N
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