Vertaline B; 16-Deoxy
AlkaPlorer ID: AK317575
Synonym: Stenophylline B
IUPAC Name: 17-[1-hydroxy-1-(5-methylpiperidin-2-yl)ethyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Structure
SMILES: CC1CCC(C(C)(O)C2CCC3C4CC=C5CC(O)CCC5(C)C4CCC32C)NC1
InChI: InChI=1S/C27H45NO2/c1-17-5-10-24(28-16-17)27(4,30)23-9-8-21-20-7-6-18-15-19(29)11-13-25(18,2)22(20)12-14-26(21,23)3/h6,17,19-24,28-30H,5,7-16H2,1-4H3
InChIKey: IYNBEJALSUEFDB-UHFFFAOYSA-N
Reference
Neoverataline A and B, two antifungal alkaloids with a novel carbon skeleton from Veratrum taliense
PubChem CID: 73743978
CAS: 91421-75-9
LOTUS: LTS0202682
COCONUT: CNP0176220.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Veratrum stenophyllum | Veratrum | Melanthiaceae | Liliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 415.66200000000026
TPSA？: 52.49
MolLogP？: 5.065400000000005
Number of H-Donors: 3
Number of H-Acceptors: 3
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|