Molecule

Hernovine

AlkaPlorer ID: AK011012

Synonym: None

IUPAC Name: (6aS)-1,11-dimethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2,10-diol

SMILES: COC1=C(O)C=CC2=C1C1=C(OC)C(O)=CC3=C1[C@H](C2)NCC3

InChI: InChI=1S/C18H19NO4/c1-22-17-12(20)4-3-9-7-11-14-10(5-6-19-11)8-13(21)18(23-2)16(14)15(9)17/h3-4,8,11,19-21H,5-7H2,1-2H3/t11-/m0/s1

InChIKey: YHVSWHLQYUURMP-NSHDSACASA-N

PubChem CID: 10425723

LOTUS: LTS0185413

SuperNatural Ⅲ: SN0450835-02

NPASS: NPC66341

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Illigera luzonensis	Illigera	Hernandiaceae	Laurales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Piper sylvaticum	Piper	Piperaceae	Piperales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Avena fatua	Avena	Poaceae	Poales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Hernandia sonora	Hernandia	Hernandiaceae	Laurales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 313.35300000000007

TPSA？: 70.95

MolLogP？: 2.5249000000000006

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 4

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
None	NON-PROTEIN TARGET	Activity	0.0	%	10.1021/np9700735
None	NON-PROTEIN TARGET	Activity	47.0	%	10.1021/np9700735
None	NON-PROTEIN TARGET	Activity	64.1	%	10.1021/np9700735
None	NON-PROTEIN TARGET	Activity	87.2	%	10.1021/np9700735