2-Amino-3-oxo-3H-phenoxazine-1,8-dicarboxylic acid; 8-Alcohol, 1-nitrile, N2-Ac
AlkaPlorer ID: AK020876
Synonym: 2-(Acetylamino)-8-(hydroxymethyl)-3-oxo-3H-phenoxazine-1-carbonitrile, Bezerramycin C
IUPAC Name: N-[1-cyano-8-(hydroxymethyl)-3-oxophenoxazin-2-yl]acetamide
Structure
SMILES: CC(O)=NC1=C(C#N)C2=NC3=CC(CO)=CC=C3OC2=CC1=O
InChI: InChI=1S/C16H11N3O4/c1-8(21)18-15-10(6-17)16-14(5-12(15)22)23-13-3-2-9(7-20)4-11(13)19-16/h2-5,20H,7H2,1H3,(H,18,21)
InChIKey: AFOCUKZGFVPLEE-UHFFFAOYSA-N
Reference
PubChem CID: 46183340
LOTUS: LTS0208820
SuperNatural Ⅲ: SN0004323
NPASS: NPC224324
COCONUT: CNP0216764
{NPAtlas: NPA006204
Source
Properties Information
Molecule Weight: 309.28100000000006
TPSA?: 119.71
MolLogP?: 2.26468
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 3
Activities Information
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