Aflavinine
AlkaPlorer ID: AK038671
Synonym: None
IUPAC Name: (1S,4R,4aS,7R,7aS,11aS)-8-(1H-indol-3-yl)-4,4a,7-trimethyl-9-propan-2-yl-1,2,3,4,5,6,7,7a,10,11-decahydrobenzo[i]naphthalen-1-ol
Structure
SMILES: CC(C)C1=C(C2=CNC3=CC=CC=C23)[C@@H]2[C@H](C)CC[C@@]3(C)[C@H](C)CC[C@H](O)[C@@]23CC1
InChI: InChI=1S/C28H39NO/c1-17(2)20-13-15-28-24(30)11-10-19(4)27(28,5)14-12-18(3)26(28)25(20)22-16-29-23-9-7-6-8-21(22)23/h6-9,16-19,24,26,29-30H,10-15H2,1-5H3/t18-,19-,24+,26+,27+,28+/m1/s1
InChIKey: LXZADDNPPHIYMD-QQVIWQHHSA-N
Reference
Aflavinine, a novel indole-mevalonate metabolite from tremorgen-producing species
PubChem CID: 21725958
LOTUS: LTS0194509
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus parasiticus | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 405.62600000000026
TPSA？: 36.02
MolLogP？: 7.200900000000007
Number of H-Donors: 2
Number of H-Acceptors: 1
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|