Daphnioldhanin A
AlkaPlorer ID: AK087121
Synonym: 'daphnioldhanin A', '(-)-Daphnioldhanin A'
IUPAC Name: methyl (1R,3R,4R,7R,10S,14S,15R,18R,19S,20S)-20-hydroxy-18-(hydroxymethyl)-14-methyl-12-azahexacyclo[10.6.1.11,4.010,18.015,19.07,20]icosane-3-carboxylate
Structure
SMILES: COC(=O)[C@@H]1C[C@]23[C@@H]4[C@@H]5CC[C@@]2(CO)[C@H](CC[C@@H]2CC[C@H]1[C@@]23O)CN4C[C@H]5C
InChI: InChI=1S/C23H35NO4/c1-13-10-24-11-15-4-3-14-5-6-18-17(20(26)28-2)9-22(23(14,18)27)19(24)16(13)7-8-21(15,22)12-25/h13-19,25,27H,3-12H2,1-2H3/t13-,14-,15-,16-,17-,18-,19+,21-,22+,23+/m1/s1
InChIKey: WOGFLAZQXDWGSH-WVWLNIHDSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Daphniphyllum oldhamii | Daphniphyllum | Daphniphyllaceae | Saxifragales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 389.5360000000002
TPSA？: 70.0
MolLogP？: 2.0556
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|