Preferred Name

1-(2-fluorophenyl)-3-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-3,6-dihydro-2H-pyran-3-yl]urea

ID

http://purl.obolibrary.org/obo/CHEBI_98430

charge

0

database_cross_reference

LINCS:LSM-9809

formula

C20H27FN4O4

has_obo_namespace

chebi_ontology

id

CHEBI:98430

in_subset

http://purl.obolibrary.org/obo/chebi#2_STAR

inchi

InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17-,18+/m0/s1

inchikey

ZHYLMLAAZLDJNG-JCGIZDLHSA-N

label

1-(2-fluorophenyl)-3-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-3,6-dihydro-2H-pyran-3-yl]urea

mass

406.452

monoisotopicmass

406.20163

notation

CHEBI:98430

prefLabel

1-(2-fluorophenyl)-3-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-3,6-dihydro-2H-pyran-3-yl]urea

smiles

CN1CCN(CC1)C(=O)C[C@@H]2C=C[C@@H]([C@H](O2)CO)NC(=O)NC3=CC=CC=C3F

treeView

http://purl.obolibrary.org/obo/CHEBI_47857

subClassOf

http://purl.obolibrary.org/obo/CHEBI_47857

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