Molecule

Hapalindole

AlkaPlorer ID: AK004090

Synonym: '', '12-epi-Hapalindole C isonitrile'

IUPAC Name: N-[(1R,2S,5S,6S)-2-ethenyl-6-(1H-indol-3-yl)-2-methyl-5-prop-1-en-2-ylcyclohexyl]methanimine

Structure

SMILES: C=C[C@]1(C)CC[C@H](C(=C)C)[C@@H](C2=CNC3=CC=CC=C23)[C@H]1N=C

InChI: InChI=1S/C21H26N2/c1-6-21(4)12-11-15(14(2)3)19(20(21)22-5)17-13-23-18-10-8-7-9-16(17)18/h6-10,13,15,19-20,23H,1-2,5,11-12H2,3-4H3/t15-,19+,20-,21-/m1/s1

InChIKey: WETBKIXRDMGMHL-CGRMTHRGSA-N

Reference

Welwitindolinones, Unusual Alkaloids from the Blue-Green Algae Hapalosiphon welwitschii and Westiella intricata. Relationship to Fischerindoles and Hapalinodoles

PubChem CID: 162884772

LOTUS: LTS0195165

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Hapalosiphon welwitschii	Hapalosiphon	Hapalosiphonaceae	Nostocales	Cyanophyceae	Cyanobacteriota	None	Bacteria

Properties Information

Molecule Weight: 306.4530000000001

TPSA？: 28.15

MolLogP？: 5.499100000000006

Number of H-Donors: 1

Number of H-Acceptors: 1

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi