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6-hydroxymetatacarboline D

AlkaPlorer ID: AK047735

Synonym: None

IUPAC Name: (2S)-1-[3-[3-[[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl]-6-hydroxy-9H-pyrido[3,4-b]indol-1-yl]propanoyl]pyrrolidine-2-carboxylic acid

Structure

SMILES: C[C@@H](O)[C@H](NC(=O)C1=CC2=C(NC3=CC=C(O)C=C32)C(CCC(=O)N2CCC[C@H]2C(=O)O)=N1)C(=O)O

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InChI: InChI=1S/C24H26N4O8/c1-11(29)20(24(35)36)27-22(32)17-10-14-13-9-12(30)4-5-15(13)26-21(14)16(25-17)6-7-19(31)28-8-2-3-18(28)23(33)34/h4-5,9-11,18,20,26,29-30H,2-3,6-8H2,1H3,(H,27,32)(H,33,34)(H,35,36)/t11-,18+,20+/m1/s1

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InChIKey: HYBYPROKTWYUIQ-PEECDGGASA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Mycena metata Mycena Mycenaceae Agaricales Agaricomycetes Basidiomycota Fungi Eukaryota

Properties Information

Molecule Weight: 498.4920000000004

TPSA？: 193.15

MolLogP？: 0.9936999999999996

Number of H-Donors: 6

Number of H-Acceptors: 7

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Bacillus pumilus Bacillus pumilus GI None None 10.1021/np300455a
Bacillus subtilis Bacillus subtilis GI None None 10.1021/np300455a
Brevibacillus brevis Brevibacillus brevis GI None None 10.1021/np300455a
Cladosporium cucumerinum Cladosporium cucumerinum GI None None 10.1021/np300455a
Escherichia coli Escherichia coli GI None None 10.1021/np300455a
Saccharomyces cerevisiae Saccharomyces cerevisiae GI None None 10.1021/np300455a

Metabolism Information