CHEBI:101000 - 3-fluoro-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-[2-(1-pyrrolidinyl)ethylamino]ethyl]-3-oxanyl]benzamide

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ChEBI Name 3-fluoro-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-[2-(1-pyrrolidinyl)ethylamino]ethyl]-3-oxanyl]benzamide
ChEBI ID CHEBI:101000
Stars This entity has been manually annotated by a third party.
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Formula C21H30FN3O4
Net Charge 0
Average Mass 407.480
Monoisotopic Mass 407.22203
InChI InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18+,19+/m0/s1
InChIKey DCVAKYLGJMAIQD-IPMKNSEASA-N
SMILES C1CCN(C1)CCNC(=O)C[C@@H]2CC[C@H]([C@H](O2)CO)NC(=O)C3=CC(=CC=C3)F
ChEBI Ontology
Outgoing 3-fluoro-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-[2-(1-pyrrolidinyl)ethylamino]ethyl]-3-oxanyl]benzamide (CHEBI:101000) is a C-glycosyl compound (CHEBI:20857)
Manual Xref Database
LSM-12373 LINCS
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