(10R)-6-[2,3-bis(acetyloxy)-5,6-dihydroxy-4-(4-hydroxyphenyl)phenyl]-10,13-bis[(2S)-butan-2-yl]-14-hydroxy-12-methoxy-11-oxo-2,9-dioxa-1,12-diazatricyclo[8.4.0.0³,⁸]tetradeca-3(8),4,6,13-tetraen-1-ium-1-olate
AlkaPlorer ID: AK430592
Synonym: None
IUPAC Name: [3-[(5S,11aR)-3,11a-bis[(2S)-butan-2-yl]-4-hydroxy-2-methoxy-5-oxido-1-oxopyrazino[1,2-b][1,4,2]benzodioxazin-5-ium-9-yl]-2-acetyloxy-4,5-dihydroxy-6-(4-hydroxyphenyl)phenyl] acetate
Structure
SMILES: CC[C@H](C)C1=C(O)[N@+]2([O-])OC3=CC=C(C4=C(O)C(O)=C(C5=CC=C(O)C=C5)C(OC(C)=O)=C4OC(C)=O)C=C3O[C@]2([C@@H](C)CC)C(=O)N1OC
InChI: InChI=1S/C35H38N2O13/c1-8-17(3)28-33(43)37(45)35(18(4)9-2,34(44)36(28)46-7)49-25-16-22(12-15-24(25)50-37)27-30(42)29(41)26(21-10-13-23(40)14-11-21)31(47-19(5)38)32(27)48-20(6)39/h10-18,40-43H,8-9H2,1-7H3/t17-,18-,35+,37-/m0/s1
InChIKey: KCXPCPJNZYKYRZ-OELYMAMWSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Sarcodon scabrosus | Sarcodon | Thelephoraceae | Thelephorales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 694.69
TPSA？: 204.58
MolLogP？: 5.908000000000007
Number of H-Donors: 4
Number of H-Acceptors: 13
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|