Cyclooroidin
AlkaPlorer ID: AK025102
Synonym: ''
IUPAC Name: (4S)-4-[(2-amino-1H-imidazol-5-yl)methyl]-6,7-dibromo-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazin-1-one
Structure
SMILES: N=C1NC=C(C[C@H]2CNC(=O)C3=CC(Br)=C(Br)N32)N1
InChI: InChI=1S/C11H11Br2N5O/c12-7-2-8-10(19)15-4-6(18(8)9(7)13)1-5-3-16-11(14)17-5/h2-3,6H,1,4H2,(H,15,19)(H3,14,16,17)/t6-/m0/s1
InChIKey: TWKBAJGOPXDKMJ-LURJTMIESA-N
Reference
Two novel pyrrole-imidazole alkaloids from the Mediterranean sponge Agelas oroides
PubChem CID: 10739060
LOTUS: LTS0088215
NPASS: NPC208180
Source
Properties Information
Molecule Weight: 389.051
TPSA?: 89.46000000000001
MolLogP?: 1.67597
Number of H-Donors: 4
Number of H-Acceptors: 3
RingCount: 3
Activities Information
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