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(Q110171274)
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English
2-(6,7-Epoxy-12-hydroxy-1-oxo-2,4,10-farnesatrien-1-yl)pyrrole; (2Z,4E,6xi,7xi,10E)-form
group of stereoisomers with the chemical formula C₁₉H₂₅NO₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
315.18344366
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₅NO₃
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canonical SMILES
O=C(C=C(C=CC1OC1(C)CCC=C(C)CO)C)C2=CC=CN2
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isomeric SMILES
CC(=C/C(=O)c1ccc[nH]1)/C=C/C1OC1(C)CC/C=C(\C)CO
1 reference
based on heuristic
inferred from InChI
found in taxon
Streptomyces
1 reference
stated in
Structural elucidation and NMR assignments of two new pyrrolosesquiterpenes from Streptomyces sp. Hd7-21.
Identifiers
InChI
InChI=1S/C19H25NO3/c1-14(12-17(22)16-7-5-11-20-16)8-9-18-19(3,23-18)10-4-6-15(2)13-21/h5-9,11-12,18,20-21H,4,10,13H2,1-3H3/b9-8+,14-12-,15-6+
0 references
InChIKey
ZYKMOCKSWCJSAG-SWFQEARZSA-N
0 references
PubChem CID
156582172
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZYKMOCKSWCJSAG-SWFQEARZSA-N
ChEBI ID
211752
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C19H25NO3/c1-14(12-17(22)16-7-5-11-20-16)8-9-18-19(3,23-18)10-4-6-15(2)13-21/h5-9,11-12,18,20-21H,4,10,13H2,1-3H3/b9-8+,14-12-,15-6+
Natural Product Atlas ID
NPA031260
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZYKMOCKSWCJSAG-SWFQEARZSA-N
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