Ardeemin; 15b-Hydroxy, 5-N-Ac
AlkaPlorer ID: AK289166
Synonym: 5-N-Acetyl-15b-hydroxyardeemin
IUPAC Name: 16-acetyl-1-hydroxy-12-methyl-23-(2-methylbut-3-en-2-yl)-3,11,14,16-tetrazahexacyclo[12.10.0.02,11.04,9.015,23.017,22]tetracosa-2,4,6,8,17,19,21-heptaene-10,13-dione
Structure
SMILES: C=CC(C)(C)C12CC3(O)C4=NC5=CC=CC=C5C(=O)N4C(C)C(=O)N3C1N(C(C)=O)C1=CC=CC=C12
InChI: InChI=1S/C28H28N4O4/c1-6-26(4,5)27-15-28(36)24-29-20-13-9-7-11-18(20)23(35)30(24)16(2)22(34)32(28)25(27)31(17(3)33)21-14-10-8-12-19(21)27/h6-14,16,25,36H,1,15H2,2-5H3
InChIKey: UTVHCNQHDCRVMF-UHFFFAOYSA-N
Reference
Bioactive Alkaloids from the Plant Endophytic Fungus<i>Aspergillus terreus</i>
PubChem CID: 78089764
CAS: 148717-81-1
LOTUS: LTS0114308
COCONUT: CNP0111820.3
Source
Properties Information
Molecule Weight: 484.5560000000002
TPSA？: 95.73999999999998
MolLogP？: 3.191300000000002
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 6
Activities Information
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