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(Q77279398)
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English
PC-766b
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
GBRLJEHLCUILHG-KIRYWGJYSA-N
1 reference
based on heuristic
inferred from SMILES
mass
776.471077616
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₄₃H₆₈O₁₂
0 references
canonical SMILES
O=C1OC(C(OC)C=CC=C(C)CC(C)C(O)C(C=C(C=C1OC)C)C)C(C)C(O)C(C)C2(O)OC(C=CC=CC)C(C)C(OC3OC(C)C(O)C(O)C3)C2
0 references
found in taxon
Nocardia brasiliensis
1 reference
stated in
PC-766B, a new macrolide antibiotic produced by Nocardia brasiliensis. II. Isolation, physico-chemical properties and structure elucidation.
Identifiers
InChI
InChI=1S/C43H68O12/c1-12-13-14-17-33-28(6)36(53-37-22-32(44)40(47)31(9)52-37)23-43(49,55-33)30(8)39(46)29(7)41-34(50-10)18-15-16-24(2)19-26(4)38(45)27(5)20-25(3)21-35(51-11)42(48)54-41/h12-18,20-21,26-34,36-41,44-47,49H,19,22-23H2,1-11H3
0 references
InChIKey
GBRLJEHLCUILHG-UHFFFAOYSA-N
2 references
stated in
PubChem
PubChem CID
74030122
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
74030122
language of work or name
English
PubChem CID
74030122
2 references
stated in
PubChem
PubChem CID
74030122
language of work or name
English
matched by identifier from
InChIKey
InChIKey
GBRLJEHLCUILHG-UHFFFAOYSA-N
ChEBI ID
200603
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C43H68O12/c1-12-13-14-17-33-28(6)36(53-37-22-32(44)40(47)31(9)52-37)23-43(49,55-33)30(8)39(46)29(7)41-34(50-10)18-15-16-24(2)19-26(4)38(45)27(5)20-25(3)21-35(51-11)42(48)54-41/h12-18,20-21,26-34,36-41,44-47,49H,19,22-23H2,1-11H3
UniChem compound ID
76997611
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA003545
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GBRLJEHLCUILHG-UHFFFAOYSA-N
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