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(Q82884415)
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English
6-O-Acetyl-1-(4-amino-3-carboxy-1-hydroxy-2,5-dioxocyclohex-3-en-1-yl)-1,5-anhydro-3-O-(2-deoxy-2-methyl-4-O-methyl-3-C-{1-[(2-methylpropanoyl)oxy]ethyl}pentopyranosyl)hexitol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
647.242534232
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₄₁NO₁₆
0 references
canonical SMILES
O=C(O)C=1C(=O)C(O)(CC(=O)C1N)C2OC(COC(=O)C)C(O)C(OC3OCC(OC)C(O)(C(OC(=O)C(C)C)C)C3C)C2O
0 references
found in taxon
Streptomyces paulus
5 references
stated in
O-demethylpaulomycins A and B, U-77,802 and U-77,803, paulomenols A and B, new metabolites produced by Streptomyces paulus
stated in
O-demethylpaulomycins A and B, U-77,802 and U-77,803, paulomenols A and B, new metabolites produced by Streptomyces paulus
stated in
O-demethylpaulomycins A and B, U-77,802 and U-77,803, paulomenols A and B, new metabolites produced by Streptomyces paulus
stated in
O-demethylpaulomycins A and B, U-77,802 and U-77,803, paulomenols A and B, new metabolites produced by Streptomyces paulus
stated in
New insights into paulomycin biosynthesis pathway in Streptomyces albus J1074 and generation of novel derivatives by combinatorial biosynthesis
Streptomyces albus
1 reference
stated in
New insights into paulomycin biosynthesis pathway in Streptomyces albus J1074 and generation of novel derivatives by combinatorial biosynthesis
Identifiers
InChI
InChI=1S/C28H41NO16/c1-10(2)25(37)43-12(4)28(39)11(3)26(42-9-16(28)40-6)45-21-19(32)15(8-41-13(5)30)44-23(20(21)33)27(38)7-14(31)18(29)17(22(27)34)24(35)36/h10-12,15-16,19-21,23,26,32-33,38-39H,7-9,29H2,1-6H3,(H,35,36)
0 references
InChIKey
IGIGICMEZXMCNM-UHFFFAOYSA-N
0 references
CAS Registry Number
97670-28-5
0 references
PubChem CID
126792
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
DSSTox substance ID
DTXSID40913746
1 reference
matched by identifier from
InChIKey
InChIKey
IGIGICMEZXMCNM-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID801342746
0 references
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