(9S)-4-methoxy-9-methyl-2H,6H,7H,8H,9H-[1,3]dioxolo[4,5-h]isoquinoline
AlkaPlorer ID: AK266486
Synonym: None
IUPAC Name: (9S)-4-methoxy-9-methyl-6,7,8,9-tetrahydro-[1,3]dioxolo[4,5-h]isoquinoline
Structure
SMILES: COC1=CC2=C(C3=C1OCO3)[C@H](C)NCC2
InChI: InChI=1S/C12H15NO3/c1-7-10-8(3-4-13-7)5-9(14-2)11-12(10)16-6-15-11/h5,7,13H,3-4,6H2,1-2H3/t7-/m0/s1
InChIKey: YEGBVDVRKMCCON-ZETCQYMHSA-N
Reference
Alkaloids from the cactus genus Gymnocalycium (Cactaceae)
PubChem CID: 16637831
CAS: 519-04-0
LOTUS: LTS0154339
SuperNatural Ⅲ: SN0448018-01
NPASS: NPC294073
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stephania rotunda | Stephania | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Hemsleya pengxianensis | Hemsleya | Cucurbitaceae | Cucurbitales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Lonchocarpus utilis | Lonchocarpus | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 221.256
TPSA？: 39.72
MolLogP？: 1.6305999999999998
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|