(10R)-10,13-bis[(2S)-butan-2-yl]-6-[2,3-dihydroxy-4-(4-hydroxyphenyl)-5,6-dioxocyclohexa-1,3-dien-1-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: AK588160
Synonym: None
IUPAC Name: 2-[(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]-3,6-dihydroxy-5-(4-hydroxyphenyl)cyclohexa-2,5-diene-1,4-dione
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(=O)C4=O)C=C3O[C@]2([C@@H](C)CC)C(=O)N1OC
InChI: InChI=1S/C31H32N2O11/c1-6-15(3)24-29(39)33(41)31(16(4)7-2,30(40)32(24)42-5)43-21-14-18(10-13-20(21)44-33)23-27(37)25(35)22(26(36)28(23)38)17-8-11-19(34)12-9-17/h8-16,34-35,37,39H,6-7H2,1-5H3/t15-,16-,31+,33?/m0/s1
InChIKey: YZZWVIPXGCWZCK-DNOYDKCLSA-N
Reference
LOTUS: LTS0168882
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hydnellum suaveolens | Hydnellum | Thelephoraceae | Thelephorales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 608.6000000000001
TPSA？: 186.12
MolLogP？: 4.702400000000003
Number of H-Donors: 4
Number of H-Acceptors: 11
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|