Stachyin A
AlkaPlorer ID: AK003800
Synonym: None
IUPAC Name: [(2S,3R,4aR,7S,8S,8aR)-3,4'-dihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-7,8-dihydro-3H-furo[2,3-e]isoindole]-2-yl] acetate
Structure
SMILES: CC(=O)O[C@H]1C[C@]2(C)[C@H](CC[C@H](C)[C@@]23CC2=C(O)C=C4C(O)=NCC4=C2O3)C(C)(C)[C@H]1O
InChI: InChI=1S/C25H33NO6/c1-12-6-7-19-23(3,4)21(29)18(31-13(2)27)10-24(19,5)25(12)9-15-17(28)8-14-16(20(15)32-25)11-26-22(14)30/h8,12,18-19,21,28-29H,6-7,9-11H2,1-5H3,(H,26,30)/t12-,18-,19+,21-,24+,25-/m0/s1
InChIKey: MLWSQMMSROWDTI-KGWQWQGISA-N
Reference
Spirocyclic Drimanes from the Marine Fungus Stachybotrys sp. Strain MF347
PubChem CID: 139587797
LOTUS: LTS0108472
{NPAtlas: NPA016901
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stachybotrys sp. | Stachybotrys | Stachybotryaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 443.5400000000002
TPSA？: 108.58
MolLogP？: 3.659000000000003
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|