CHEBI:103305 - LSM-14649

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ChEBI Name LSM-14649
ChEBI ID CHEBI:103305
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C27H33FN4O4
Net Charge 0
Average Mass 496.575
Monoisotopic Mass 496.24858
InChI InChI=1S/C27H33FN4O4/c1-4-8-17-11-12-21-24-23(25(34)29-13-7-14-30(2)3)19(16-33)22(15-31(21)26(17)35)32(24)27(36)18-9-5-6-10-20(18)28/h4-6,8-12,19,22-24,33H,7,13-16H2,1-3H3,(H,29,34)/t19-,22-,23+,24+/m0/s1
InChIKey ZXRDMZYXGOPOHF-ZMUKGBGYSA-N
SMILES CC=CC1=CC=C2[C@@H]3[C@@H]([C@H]([C@@H](N3C(=O)C4=CC=CC=C4F)CN2C1=O)CO)C(=O)NCCCN(C)C
ChEBI Ontology
Outgoing LSM-14649 (CHEBI:103305) is a carbonyl compound (CHEBI:36586)
LSM-14649 (CHEBI:103305) is a organohalogen compound (CHEBI:17792)
Manual Xref Database
LSM-14649 LINCS
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