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(Q104913807)
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English
ent-Roseophilin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
pyrrole alkaloid
0 references
mass
452.223055976
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Roseophilin
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₇H₃₃ClN₂O₂
0 references
canonical SMILES
ClC=1C=CNC1C=2OC(=C(OC)C2)C3=C4N=C5C=C4C(C3CCCCCCCC5)C(C)C
0 references
isomeric SMILES
COc1cc(-c2[nH]ccc2Cl)oc1C1=C2N=C3C=C2[C@@H](C(C)C)[C@@H]1CCCCCCCC3
0 references
found in taxon
Streptomyces griseoviridis
1 reference
stated in
Structure of a new antibiotic, roseophilin
Identifiers
InChI
InChI=1S/C27H33ClN2O2/c1-16(2)23-18-11-9-7-5-4-6-8-10-17-14-19(23)25(30-17)24(18)27-22(31-3)15-21(32-27)26-20(28)12-13-29-26/h12-16,18,23,29H,4-11H2,1-3H3/t18-,23-/m0/s1
0 references
InChIKey
AKRWVQHAEBBOTI-MBSDFSHPSA-N
0 references
PubChem CID
135542556
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AKRWVQHAEBBOTI-MBSDFSHPSA-N
UniChem compound ID
32581086
1 reference
stated in
UniChem
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