N-[(1S,2R,5S,7S,10S,11S,14S,15R,16S,17R,18S,20S,23S)-18-hydroxy-10,14,16,20-tetramethyl-22-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁵,²³.0¹⁷,²²]tetracosan-7-yl]formamide
AlkaPlorer ID: AK036034
Synonym: None
IUPAC Name: N-[(1S,2R,5S,7S,10S,11S,14S,15R,16S,17R,18S,20S,23S)-18-hydroxy-10,14,16,20-tetramethyl-22-azahexacyclo[12.10.0.02,11.05,10.015,23.017,22]tetracosan-7-yl]formamide
Structure
SMILES: C[C@H]1C[C@H](O)[C@H]2[C@@H](C)[C@H]3[C@H](C[C@H]4[C@@H]5CC[C@H]6C[C@@H](N=CO)CC[C@]6(C)[C@H]5CC[C@]34C)N2C1
InChI: InChI=1S/C28H46N2O2/c1-16-11-24(32)26-17(2)25-23(30(26)14-16)13-22-20-6-5-18-12-19(29-15-31)7-9-27(18,3)21(20)8-10-28(22,25)4/h15-26,32H,5-14H2,1-4H3,(H,29,31)/t16-,17-,18-,19-,20+,21-,22-,23-,24-,25-,26+,27-,28-/m0/s1
InChIKey: FFBKXNVIQQUUJG-NFADKULFSA-N
Reference
Solanopubamides a and b, two further steroidal alkaloids from solanum pu bescens
PubChem CID: 163060580
LOTUS: LTS0161225
SuperNatural Ⅲ: SN0083981-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Solanum pubescens | Solanum | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 442.6880000000003
TPSA?: 56.06000000000001
MolLogP?: 5.299700000000005
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|
