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(Q77384070)
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English
Asterobactin B
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
783.401434884
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₅H₅₇N₇O₁₃
0 references
canonical SMILES
CCCCCCCCCC(OC(=O)C(CCCN(O)C=O)NC(=O)C(O)COC(=O)c1ccccc1O)C(C)C(=O)NC(CCCN(O)C(=N)N)C(=O)NO
0 references
found in taxon
Nocardia asteroides
1 reference
stated in
Asterobactin, a new siderophore group antibiotic from Nocardia asteroides
Identifiers
InChI
InChI=1S/C35H57N7O13/c1-3-4-5-6-7-8-9-18-29(23(2)30(46)38-25(31(47)40-51)15-13-20-42(53)35(36)37)55-34(50)26(16-12-19-41(52)22-43)39-32(48)28(45)21-54-33(49)24-14-10-11-17-27(24)44/h10-11,14,17,22-23,25-26,28-29,44-45,51-53H,3-9,12-13,15-16,18-21H2,1-2H3,(H3,36,37)(H,38,46)(H,39,48)(H,40,47)
0 references
InChIKey
HQVYJMIMXNUBLA-UHFFFAOYSA-N
2 references
stated in
PubChem
PubChem CID
139585116
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
139585116
language of work or name
English
PubChem CID
139585116
2 references
stated in
PubChem
PubChem CID
139585116
language of work or name
English
matched by identifier from
InChIKey
InChIKey
HQVYJMIMXNUBLA-UHFFFAOYSA-N
ChEBI ID
204138
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C35H57N7O13/c1-3-4-5-6-7-8-9-18-29(23(2)30(46)38-25(31(47)40-51)15-13-20-42(53)35(36)37)55-34(50)26(16-12-19-41(52)22-43)39-32(48)28(45)21-54-33(49)24-14-10-11-17-27(24)44/h10-11,14,17,22-23,25-26,28-29,44-45,51-53H,3-9,12-13,15-16,18-21H2,1-2H3,(H3,36,37)(H,38,46)(H,39,48)(H,40,47)
UniChem compound ID
170908510
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA007189
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HQVYJMIMXNUBLA-UHFFFAOYSA-N
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