Hapalindole O
AlkaPlorer ID: AK016591
Synonym: None
IUPAC Name: (2R,3R,4R,5R,7S)-4-ethenyl-3-isothiocyanato-4,8,8-trimethyl-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),9(16),10,12-tetraen-5-ol
Structure
SMILES: C=C[C@@]1(C)[C@H](O)C[C@H]2[C@H](C3=CNC4=CC=CC(=C34)C2(C)C)[C@H]1N=C=S
InChI: InChI=1S/C21H24N2OS/c1-5-21(4)16(24)9-14-18(19(21)23-11-25)12-10-22-15-8-6-7-13(17(12)15)20(14,2)3/h5-8,10,14,16,18-19,22,24H,1,9H2,2-4H3/t14-,16+,18-,19+,21-/m0/s1
InChIKey: NUQRVLVXINMDRL-DJNKVENRSA-N
Reference
Unusual cyclopropane-containing hapalindolinones from a cultured cyanobacterium
PubChem CID: 10383388
LOTUS: LTS0242431
{NPAtlas: NPA019388
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Fontinalis | Fontinalaceae | Hypnales | Bryopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 352.50300000000004
TPSA？: 48.38
MolLogP？: 4.587200000000004
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|