LSM-36516
(Q27215391)
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chemical compound
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Language
Label
Description
Also known as
English
LSM-36516
chemical compound
Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
434.14642719599993
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₅H₂₃FN₂O₂S
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
C1=CC=C(C=C1)C=CC2=CC=C(C=C2)C3(C4(CN(CC3(N4)[H])S(C5=CC=C(C=C5)F)(=O)=O)[H])[H]
1 reference
stated in
ChEBI
ChEBI ID
125054
language of work or name
English
title
LSM-36516
(English)
retrieved
11 October 2016
isomeric SMILES
C1=CC=C(C=C1)C=CC2=CC=C(C=C2)C3([C@@]4(CN(C[C@]3(N4)[H])S(C5=CC=C(C=C5)F)(=O)=O)[H])[H]
1 reference
stated in
ChEBI
ChEBI ID
125054
language of work or name
English
title
LSM-36516
(English)
retrieved
11 October 2016
Identifiers
InChI
InChI=1S/C25H23FN2O2S/c26-21-12-14-22(15-13-21)31(29,30)28-16-23-25(24(17-28)27-23)20-10-8-19(9-11-20)7-6-18-4-2-1-3-5-18/h1-15,23-25,27H,16-17H2/t23-,24+,25?
1 reference
stated in
ChEBI
ChEBI ID
125054
language of work or name
English
title
LSM-36516
(English)
retrieved
11 October 2016
InChIKey
RYKGWQYDSBDOQK-XMGLRAKGSA-N
2 references
stated in
ChEBI
ChEBI ID
125054
language of work or name
English
title
LSM-36516
(English)
retrieved
11 October 2016
stated in
ChEBI release 2020-09-01
PubChem CID
139032386
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
RYKGWQYDSBDOQK-XMGLRAKGSA-N
ChEBI ID
125054
mapping relation type
exact match
2 references
stated in
ChEBI
ChEBI ID
125054
language of work or name
English
title
LSM-36516
(English)
retrieved
11 October 2016
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C25H23FN2O2S/c26-21-12-14-22(15-13-21)31(29,30)28-16-23-25(24(17-28)27-23)20-10-8-19(9-11-20)7-6-18-4-2-1-3-5-18/h1-15,23-25,27H,16-17H2/t23-,24+,25?
UniChem compound ID
101754472
1 reference
stated in
UniChem
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