coreanine A
AlkaPlorer ID: AK010505
Synonym: None
IUPAC Name: None
Structure
SMILES: CC(CC)C(O[C@H]1C[C@]2(C)C([C@@H]3C[C@]4(C5)C6[C@H](O)[C@H](C(OC(C)=O)[C@@]4(O)C7[N@]3C2)C5=C)[C@@]67C1)=O
InChI: InChI=1S/C27H37NO6/c1-6-12(2)22(31)34-15-8-24(5)11-28-16-10-25-7-13(3)17-18(30)20(25)26(9-15,19(16)24)23(28)27(25,32)21(17)33-14(4)29/h12,15-21,23,30,32H,3,6-11H2,1-2,4-5H3/t12?,15-,16-,17+,18+,19?,20?,21?,23?,24-,25+,26-,27+/m0/s1
InChIKey: WWKNIYNAGJHDNE-LJKKQRPQSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aconitum coreanum | Aconitum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 471.59400000000034
TPSA？: 96.29999999999998
MolLogP？: 2.0466999999999995
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 9
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|