20-Aminopregnan-3-ol; (3β,5α,20S)-form, N,N-Di-Me, O-β-D-glucopyranoside
AlkaPlorer ID: AK287258
Synonym: Pachyaxioside A
IUPAC Name: 2-[[17-[1-(dimethylamino)ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Structure
SMILES: CC(C1CCC2C3CCC4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC21C)N(C)C
InChI: InChI=1S/C29H51NO6/c1-16(30(4)5)20-8-9-21-19-7-6-17-14-18(10-12-28(17,2)22(19)11-13-29(20,21)3)35-27-26(34)25(33)24(32)23(15-31)36-27/h16-27,31-34H,6-15H2,1-5H3
InChIKey: UDDHPCXVYFUPQP-UHFFFAOYSA-N
Reference
CAS: 128255-18-5
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pachysandra axillaris | Pachysandra | Buxaceae | Buxales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 509.7280000000004
TPSA？: 102.62
MolLogP？: 2.7805
Number of H-Donors: 4
Number of H-Acceptors: 7
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|