Complanadine A
AlkaPlorer ID: AK083112
Synonym: None
IUPAC Name: (1R,9S,10R,16R)-16-methyl-4-[(1R,9S,10R,16R)-16-methyl-6,14-diazatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-5-yl]-6,14-diazatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene
Structure
SMILES: C[C@@H]1C[C@H]2CC3=NC=C(C4=CC=C5C(=N4)C[C@@H]4C[C@@H](C)C[C@]56NCCC[C@H]46)C=C3[C@]3(C1)NCCC[C@H]23
InChI: InChI=1S/C32H42N4/c1-19-12-22-15-30-26(31(16-19)24(22)5-3-9-34-31)7-8-28(36-30)23-13-27-29(33-18-23)14-21-11-20(2)17-32(27)25(21)6-4-10-35-32/h7-8,13,18-22,24-25,34-35H,3-6,9-12,14-17H2,1-2H3/t19-,20-,21+,22+,24-,25-,31-,32-/m1/s1
InChIKey: CBERWKKQXZDPGS-AKGGLISVSA-N
Reference
Complanadine A, a new dimeric alkaloid from Lycopodium complanatum
PubChem CID: 11443064
LOTUS: LTS0089134
SuperNatural Ⅲ: SN0041003-02
NPASS: NPC201634
Source
Properties Information
Molecule Weight: 482.7160000000004
TPSA？: 49.84
MolLogP？: 5.737800000000005
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Beta-nerve growth factor | Activity | nan | None | 10.1016/j.bmc.2010.12.025 |
| Homo sapiens | Beta-nerve growth factor | FC | 3.9 | None | 10.1016/j.bmc.2010.12.025 |