Melodinine N; 14α,15α-Epoxide

AlkaPlorer ID: AK305468

Synonym: Melofusine E

IUPAC Name: None

Structure

SMILES: CCC12CC(C(=O)OC)=C3NC4=CC(O)=C(C)C=C4C34CCN(CC3OC31)C42

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InChI: InChI=1S/C22H26N2O4/c1-4-21-9-12(19(26)27-3)17-22(13-7-11(2)15(25)8-14(13)23-17)5-6-24(20(21)22)10-16-18(21)28-16/h7-8,16,18,20,23,25H,4-6,9-10H2,1-3H3

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InChIKey: FAQUHEHJWUHTIA-UHFFFAOYSA-N

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Reference

CAS: 2186664-99-1

Source

Properties Information

Molecule Weight: 382.4600000000002

TPSA: 74.33

MolLogP: 2.4464200000000007

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information