Anhydrohapaloxindole B
AlkaPlorer ID: AK000030
Synonym: None
IUPAC Name: (3R,4R,5R,7R)-5-chloro-4-ethenyl-3-isothiocyanato-4,8,8-trimethyl-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1,9(16),10,12-tetraen-15-one
Structure
SMILES: C=C[C@@]1(C)[C@H](Cl)C[C@H]2C(=C3C(O)=NC4=C3C(=CC=C4)C2(C)C)[C@H]1N=C=S
InChI: InChI=1S/C21H21ClN2OS/c1-5-21(4)14(22)9-12-16(18(21)23-10-26)17-15-11(20(12,2)3)7-6-8-13(15)24-19(17)25/h5-8,12,14,18H,1,9H2,2-4H3,(H,24,25)/t12-,14+,18+,21-/m0/s1
InChIKey: POWOOZMDXKYYOK-FWKFCYAVSA-N
Reference
Hapalonamides and other oxidized hapalindoles from Hapalosiphon fontinalis
PubChem CID: 14314377
LOTUS: LTS0250268
SuperNatural Ⅲ: SN0291275-02
{NPAtlas: NPA031285
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Fontinalis | Fontinalaceae | Hypnales | Bryopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 384.9320000000001
TPSA？: 44.95
MolLogP？: 5.624000000000006
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|