CHEBI:101048 - 2-[(3R,6aR,8R,10aR)-3-hydroxy-1-methyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-cyclobutylacetamide

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ChEBI Name 2-[(3R,6aR,8R,10aR)-3-hydroxy-1-methyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-cyclobutylacetamide
ChEBI ID CHEBI:101048
Stars This entity has been manually annotated by a third party.
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Formula C16H28N2O4
Net Charge 0
Average Mass 312.405
Monoisotopic Mass 312.20491
InChI InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13-,14-,15+/m1/s1
InChIKey JDRFUATZRDBDCA-TUVASFSCSA-N
SMILES CN1C[C@H](COC[C@H]2[C@H]1CC[C@@H](O2)CC(=O)NC3CCC3)O
ChEBI Ontology
Outgoing 2-[(3R,6aR,8R,10aR)-3-hydroxy-1-methyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-cyclobutylacetamide (CHEBI:101048) is a oxanes (CHEBI:46942)
Manual Xref Database
LSM-12421 LINCS
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