Celastromeline
AlkaPlorer ID: AK291850
Synonym: None
IUPAC Name: None
Structure
SMILES: CCC12C=CCN3CCC4=C(C31)N(C1=CC=CC=C41)C(N1C3=CC=CC=C3C3C4N5CCCC4(CC)CCC31CC5)C2
InChI: InChI=1S/C38H46N4/c1-3-36-16-9-22-40-24-20-38(19-18-36)32(34(36)40)28-12-6-8-14-30(28)42(38)31-25-37(4-2)17-10-21-39-23-15-27-26-11-5-7-13-29(26)41(31)33(27)35(37)39/h5-8,10-14,17,31-32,34-35H,3-4,9,15-16,18-25H2,1-2H3
InChIKey: RPZPFKDRUQVRGO-UHFFFAOYSA-N
Reference
CAS: 135626-52-7
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Melodinus | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 558.8140000000002
TPSA？: 14.65
MolLogP？: 7.809900000000009
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 10
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|