(1R,2S,6R,9S,10R,11R,14R,17R,18S,20R,23S)-6,10,23-trimethyl-4-azahexacyclo[12.11.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁴.0¹⁸,²³]pentacos-15(24)-ene-17,20-diol
AlkaPlorer ID: AK141106
Synonym: None
IUPAC Name: (2S,6R,10R,23S)-6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacos-15(24)-ene-17,20-diol
Structure
SMILES: C[C@@H]1CCC2[C@H](C)C3CCC4C5=C(CC4[C@@H]3CN2C1)[C@@]1(C)CCC(O)CC1C(O)C5
InChI: InChI=1S/C27H43NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-20,22,24-26,29-30H,4-14H2,1-3H3/t15-,16-,17?,18?,19?,20?,22-,24?,25?,26?,27-/m1/s1
InChIKey: GPOVTJUXVPPEKR-GLGCTGHMSA-N
Reference
Structure and configuration of severtzidine
PubChem CID: 5318841
LOTUS: LTS0220466
NPASS: NPC89334
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Fritillaria cirrhosa | Fritillaria | Liliaceae | Liliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 413.6460000000002
TPSA？: 43.7
MolLogP？: 4.627400000000006
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|