Dihydrotubingensin A
AlkaPlorer ID: AK038370
Synonym: '', 'Dihydrotubingensin A'
IUPAC Name: (16S,17R,20S,21R)-16,17-dimethyl-21-(4-methylpent-3-enyl)-10-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1(13),3(11),4,6,8-pentaen-20-ol
Structure
SMILES: CC(C)=CCC[C@]12C3=C(CC[C@@]1(C)[C@H](C)CC[C@@H]2O)CC1=C(C3)C2=CC=CC=C2N1
InChI: InChI=1S/C28H37NO/c1-18(2)8-7-14-28-23-17-22-21-9-5-6-10-24(21)29-25(22)16-20(23)13-15-27(28,4)19(3)11-12-26(28)30/h5-6,8-10,19,26,29-30H,7,11-17H2,1-4H3/t19-,26+,27+,28-/m1/s1
InChIKey: VNRBHDIODBBYFF-AIERRPMVSA-N
Reference
Dihydrocarbazole Alkaloids from <i>Aspergillus </i><i>t</i><i>ubingensis</i>
PubChem CID: 11036873
LOTUS: LTS0194113
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus tubingensis | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 403.6100000000001
TPSA？: 36.02
MolLogP？: 6.886800000000008
Number of H-Donors: 2
Number of H-Acceptors: 1
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|