Talaroconvolutin D
AlkaPlorer ID: AK033980
Synonym: None
IUPAC Name: 6-[(1R,2S,4aS,6S,8aR)-3,4a,6-trimethyl-2-[(E)-4-methylhex-2-en-2-yl]-2,5,6,7,8,8a-hexahydro-1H-naphthalene-1-carbonyl]-3a-[(4-hydroxyphenyl)methyl]-2,2-dimethyl-6,6a-dihydro-4H-[1,3]dioxolo[4,5-b]pyrrol-5-one
Structure
SMILES: CCC(C)/C=C(\C)[C@H]1C(C)=C[C@@]2(C)C[C@@H](C)CC[C@@H]2[C@H]1C(=O)C1C(O)=NC2(CC3=CC=C(O)C=C3)OC(C)(C)OC12
InChI: InChI=1S/C35H49NO5/c1-9-20(2)16-22(4)27-23(5)18-34(8)17-21(3)10-15-26(34)28(27)30(38)29-31-35(36-32(29)39,41-33(6,7)40-31)19-24-11-13-25(37)14-12-24/h11-14,16,18,20-21,26-29,31,37H,9-10,15,17,19H2,1-8H3,(H,36,39)/b22-16+/t20?,21-,26+,27-,28+,29?,31?,34+,35?/m0/s1
InChIKey: QHDBOFOXZOOICM-ZSXAJSSESA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Talaromyces convolutus | Talaromyces | Trichocomaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 563.7790000000002
TPSA？: 88.35000000000001
MolLogP？: 7.565100000000009
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Aspergillus fumigatus | Aspergillus fumigatus | Activ ity | None | None | 10.1021/np990371x |
| Aspergillus niger | Aspergillus niger | Activity | None | None | 10.1021/np990371x |
| Candida albicans | Candida albicans | Activity | None | None | 10.1021/np990371x |
| Cryptococcus neoformans | Cryptococcus neoformans | Activity | None | None | 10.1021/np990371x |