247590-59-6
AlkaPlorer ID: AK015419
Synonym: 'Secobatzelline A', '(-)-Secobatzelline A'
IUPAC Name: 4-amino-5-chloro-3-[(1S)-1,2-dihydroxyethyl]-6-imino-1H-indol-7-one
Structure
SMILES: N=C1C(Cl)=C(N)C(=O)C2=C1C([C@H](O)CO)=CN2
InChI: InChI=1S/C10H10ClN3O3/c11-6-7(12)5-3(4(16)2-15)1-14-9(5)10(17)8(6)13/h1,4,12,14-16H,2,13H2/t4-/m1/s1
InChIKey: HKOYUVBHEPHPMA-SCSAIBSYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | None | Chondropsidae | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 255.66100000000003
TPSA？: 123.19
MolLogP？: 0.0136700000000001
Number of H-Donors: 5
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|