Metatacarboline B
AlkaPlorer ID: AK069323
Synonym: None
IUPAC Name: (2S)-1-[3-[3-[[(1S)-4-amino-1-carboxy-4-oxobutyl]carbamoyl]-9H-pyrido[3,4-b]indol-1-yl]propanoyl]pyrrolidine-2-carboxylic acid
Structure
SMILES: N=C(O)CC[C@H](NC(=O)C1=CC2=C(NC3=CC=CC=C32)C(CCC(=O)N2CCC[C@H]2C(=O)O)=N1)C(=O)O
InChI: InChI=1S/C25H27N5O7/c26-20(31)9-7-17(24(34)35)29-23(33)18-12-14-13-4-1-2-5-15(13)28-22(14)16(27-18)8-10-21(32)30-11-3-6-19(30)25(36)37/h1-2,4-5,12,17,19,28H,3,6-11H2,(H2,26,31)(H,29,33)(H,34,35)(H,36,37)/t17-,19-/m0/s1
InChIKey: UOPJGWVZRMXEJR-HKUYNNGSSA-N
Reference
HR-MALDI-MS Imaging Assisted Screening of β-Carboline Alkaloids Discovered from <i>Mycena metata</i>
PubChem CID: 71578887
LOTUS: LTS0269803
{NPAtlas: NPA005539
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mycena metata | Mycena | Mycenaceae | Agaricales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 509.51900000000046
TPSA？: 196.76999999999995
MolLogP？: 2.22277
Number of H-Donors: 6
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|