3,4,8-Trihydroxy-10-nitro-1-phenanthrenecarboxylic acid; 4,8-Di-Me ether, Me ester
AlkaPlorer ID: AK316594
Synonym: Methyl 3-hydroxy-4,8-dimethoxy-10-nitro-1-phenanthrenecarboxylate, Ariskanin D
IUPAC Name: methyl 3-hydroxy-4,8-dimethoxy-10-nitrophenanthrene-1-carboxylate
Structure
SMILES: COC(=O)C1=CC(O)=C(OC)C2=C3C=CC=C(OC)C3=CC([N+](=O)[O-])=C12
InChI: InChI=1S/C18H15NO7/c1-24-14-6-4-5-9-10(14)7-12(19(22)23)15-11(18(21)26-3)8-13(20)17(25-2)16(9)15/h4-8,20H,1-3H3
InChIKey: IBMRJTDZJONBHH-UHFFFAOYSA-N
Reference
Aristolochic acids, aristolactam alkaloids and amides from Aristolochia kankauensis
PubChem CID: 10406029
CAS: 157207-63-1
LOTUS: LTS0159966
SuperNatural Ⅲ: SN0141185
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aristolochia kankauensis | Aristolochia | Aristolochiaceae | Piperales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 357.3180000000001
TPSA？: 108.13000000000002
MolLogP？: 3.4106000000000023
Number of H-Donors: 1
Number of H-Acceptors: 7
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|