None
AlkaPlorer ID: AK325110
Synonym: None
IUPAC Name: [(5S,6S,8R,13R,14R,18R)-11-ethyl-5,8,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
Structure
SMILES: CCN1C[C@@]2(COC)C3[C@@H](OC)C4C1C3(C(OC)C[C@H]2O)C1C[C@@]2(O)C(OC(=O)C3=CC=CC=C3)C1[C@]4(O)C[C@@H]2OC
InChI: InChI=1S/C32H45NO9/c1-6-33-15-29(16-38-2)19(34)12-20(39-3)32-18-13-30(36)21(40-4)14-31(37,23(26(32)33)24(41-5)25(29)32)22(18)27(30)42-28(35)17-10-8-7-9-11-17/h7-11,18-27,34,36-37H,6,12-16H2,1-5H3/t18?,19-,20?,21+,22?,23?,24+,25?,26?,27?,29+,30+,31-,32?/m1/s1
InChIKey: WCJLKJORIRSXRT-UBFBWQBQSA-N
Reference
NPASS: NPC55
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aconitum liljestrandii | Aconitum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 587.7100000000003
TPSA？: 127.15
MolLogP？: 1.106500000000003
Number of H-Donors: 3
Number of H-Acceptors: 10
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|