Molecule

3,4-Dihydroxy-10-nitro-1-phenanthrenecarboxylic acid; Di-Me ether, Me ester

AlkaPlorer ID: AK296330

Synonym: Methyl 3,4-dimethoxy-10-nitro-1-phenanthrenecarboxylate, Ariskanin A, Aristolochic acid BII methyl ester

IUPAC Name: methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate

SMILES: COC(=O)C1=CC(OC)=C(OC)C2=C3C=CC=CC3=CC([N+](=O)[O-])=C12

InChI: InChI=1S/C18H15NO6/c1-23-14-9-12(18(20)25-3)15-13(19(21)22)8-10-6-4-5-7-11(10)16(15)17(14)24-2/h4-9H,1-3H3

InChIKey: SJFUNPNDPBAPCB-UHFFFAOYSA-N

PubChem CID: 5320068

CAS: 128397-31-9

LOTUS: LTS0250573

SuperNatural Ⅲ: SN0347002

NPASS: NPC206052

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Akebia quinata	Akebia	Lardizabalaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Aristolochia debilis	Aristolochia	Aristolochiaceae	Piperales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Aristolochia manshuriensis	Aristolochia	Aristolochiaceae	Piperales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Aristolochia kankauensis	Aristolochia	Aristolochiaceae	Piperales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 341.31900000000013

TPSA？: 87.9

MolLogP？: 3.7050000000000014

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 3

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi