Hapalindole F

AlkaPlorer ID: AK005617

Synonym: None

IUPAC Name: 3-[(1R,2S,3S,4S,6R)-4-chloro-3-ethenyl-2-isothiocyanato-3-methyl-6-prop-1-en-2-ylcyclohexyl]-1H-indole

Structure

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

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InChI: InChI=1S/C21H23ClN2S/c1-5-21(4)18(22)10-15(13(2)3)19(20(21)24-12-25)16-11-23-17-9-7-6-8-14(16)17/h5-9,11,15,18-20,23H,1-2,10H2,3-4H3/t15-,18-,19+,20-,21+/m0/s1

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InChIKey: GRQUFNAGGOBDNI-FARZLIQASA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
None Fontinalis Fontinalaceae Hypnales Bryopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 370.94900000000007

TPSA: 28.15

MolLogP: 6.118600000000006

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information