Nucleocidin

AlkaPlorer ID: AK308259

Synonym: 4'-C-Fluoroadenosine 5'-sulfamate, T 3018, Antibiotic T 3018 

IUPAC Name: [5-(6-aminopurin-9-yl)-2-fluoro-3,4-dihydroxyoxolan-2-yl]methyl sulfamate

Structure

SMILES: NC1=NC=NC2=C1N=CN2C1OC(F)(COS(N)(=O)=O)C(O)C1O

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InChI: InChI=1S/C10H13FN6O6S/c11-10(1-22-24(13,20)21)6(19)5(18)9(23-10)17-3-16-4-7(12)14-2-15-8(4)17/h2-3,5-6,9,18-19H,1H2,(H2,12,14,15)(H2,13,20,21)

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InChIKey: LTBCQBSAWAZBDF-UHFFFAOYSA-N

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Reference

PubChem CID: 351320

CAS: 24751-69-7

COCONUT: CNP0142583.2

Source

Properties Information

Molecule Weight: 364.31500000000005

TPSA: 188.7

MolLogP: -2.4549999999999987

Number of H-Donors: 4

Number of H-Acceptors: 11

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information