Varamine B
AlkaPlorer ID: AK033615
Synonym: None
IUPAC Name: N-[2-(12-methoxy-11-methylsulfanyl-8,14-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,9,11,13,15-octaen-10-yl)ethyl]acetamide
Structure
SMILES: COC1=C(SC)C(CCN=C(C)O)=C2NC3=CC=CC=C3C3=CC=NC1=C32
InChI: InChI=1S/C21H21N3O2S/c1-12(25)22-10-9-15-18-17-14(13-6-4-5-7-16(13)24-18)8-11-23-19(17)20(26-2)21(15)27-3/h4-8,11,24H,9-10H2,1-3H3,(H,22,25)
InChIKey: ZXFLZRXTBNTTBT-UHFFFAOYSA-N
Reference
Varamines A and B, new cytotoxic thioalkaloids from Lissoclinum vareau
PubChem CID: 180092
CAS: 122093-16-7
LOTUS: LTS0132234
COCONUT: CNP0289797
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lissoclinum vareau | Lissoclinum | Didemnidae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 379.48500000000007
TPSA？: 66.74000000000001
MolLogP？: 5.208200000000004
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|