Cryptocin
AlkaPlorer ID: AK032575
Synonym: None
IUPAC Name: (5S)-3-[(1S,2S,4aR,6S,8aS)-1,2,6-trimethyl-4a,5,6,7,8,8a-hexahydro-2H-naphthalene-1-carbonyl]-5-[(1R)-1-hydroxyethyl]-1-methylpyrrolidine-2,4-dione
Structure
SMILES: C[C@H]1CC[C@H]2[C@@H](C=C[C@H](C)[C@]2(C)C(=O)C2C(=O)[C@H]([C@@H](C)O)N(C)C2=O)C1
InChI: InChI=1S/C21H31NO4/c1-11-6-9-15-14(10-11)8-7-12(2)21(15,4)19(25)16-18(24)17(13(3)23)22(5)20(16)26/h7-8,11-17,23H,6,9-10H2,1-5H3/t11-,12-,13+,14-,15-,16?,17-,21-/m0/s1
InChIKey: MQFIBLPYJVBNLZ-ALGQCLKLSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cryptosporiopsis sp. | Cryptosporiopsis | Dermateaceae | Helotiales | Leotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 361.4820000000001
TPSA？: 74.68
MolLogP？: 2.2268
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|