19-(2-acetamido-2-deoxy-α-D-glucopyranosyloxy)-3β-hydroxyisopimara-8,15-dien-7-one
AlkaPlorer ID: AK116843
Synonym: None
IUPAC Name: N-[(2S,3R,4R,5S,6R)-2-[[(1S,2S,4aS,7S,10aR)-7-ethenyl-2-hydroxy-1,4a,7-trimethyl-9-oxo-2,3,4,5,6,8,10,10a-octahydrophenanthren-1-yl]methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Structure
SMILES: C=C[C@@]1(C)CCC2=C(C1)C(=O)C[C@H]1[C@@](C)(CO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N=C(C)O)[C@@H](O)CC[C@]21C
InChI: InChI=1S/C28H43NO8/c1-6-26(3)9-7-17-16(12-26)18(32)11-20-27(17,4)10-8-21(33)28(20,5)14-36-25-22(29-15(2)31)24(35)23(34)19(13-30)37-25/h6,19-25,30,33-35H,1,7-14H2,2-5H3,(H,29,31)/t19-,20-,21+,22-,23-,24-,25+,26+,27-,28-/m1/s1
InChIKey: RLULVWNWQFIJAC-ONIMNCRVSA-N
Reference
Isopimarane diterpene glycosides, isolated from endophytic fungus Paraconiothyrium sp. MY-42
PubChem CID: 53388462
LOTUS: LTS0203320
{NPAtlas: NPA018317
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Paraconiothyrium sp. MY-42 | Paraconiothyrium | Didymosphaeriaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 521.6510000000002
TPSA？: 149.04
MolLogP？: 2.2161
Number of H-Donors: 5
Number of H-Acceptors: 8
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|