Coccutrine
AlkaPlorer ID: AK108811
Synonym: ''
IUPAC Name: (2S,13bS)-2,10-dimethoxy-2,3,5,6,8,9-hexahydro-1H-indolo[7a,1-a]isoquinolin-12-ol
Structure
SMILES: COC1=CC(O)=CC2=C1CCN1CCC3=CC[C@H](OC)C[C@]321
InChI: InChI=1S/C18H23NO3/c1-21-14-4-3-12-5-7-19-8-6-15-16(18(12,19)11-14)9-13(20)10-17(15)22-2/h3,9-10,14,20H,4-8,11H2,1-2H3/t14-,18-/m0/s1
InChIKey: RDXIEGVPUDECJS-KSSFIOAISA-N
Reference
Alkaloids of Cocculus trilobus DC. Isolation and Structure of Erythrinan Alkaloids
PubChem CID: 162975840
LOTUS: LTS0258406
SuperNatural Ⅲ: SN0322731-02
NPASS: NPC179597
Source
Properties Information
Molecule Weight: 301.386
TPSA?: 41.93000000000001
MolLogP?: 2.5931000000000006
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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