Navigation

name Structure Reference Source Properties Activities Metabolism

Cyanopeptolin B

AlkaPlorer ID: AK014154

Synonym: None

IUPAC Name: (3S)-4-[[(2S,5S,8S,11R,12S,15S,18S,21R)-15-(4-aminobutyl)-5-benzyl-21-hydroxy-4,11-dimethyl-2-(2-methylpropyl)-3,6,9,13,16,22-hexaoxo-8-propan-2-yl-10-oxa-1,4,7,14,17-pentazabicyclo[16.3.1]docosan-12-yl]amino]-3-(hexanoylamino)-4-oxobutanoic acid

Structure

SMILES: CCCCCC(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H]1C(O)=N[C@@H](CCCCN)C(O)=N[C@H]2CC[C@@H](O)N(C2=O)[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC2=CC=CC=C2)C(O)=N[C@@H](C(C)C)C(=O)O[C@@H]1C

copy

InChI: InChI=1S/C46H72N8O12/c1-8-9-11-19-35(55)48-32(25-37(57)58)41(60)52-39-28(6)66-46(65)38(27(4)5)51-42(61)33(24-29-16-12-10-13-17-29)53(7)45(64)34(23-26(2)3)54-36(56)21-20-31(44(54)63)50-40(59)30(49-43(39)62)18-14-15-22-47/h10,12-13,16-17,26-28,30-34,36,38-39,56H,8-9,11,14-15,18-25,47H2,1-7H3,(H,48,55)(H,49,62)(H,50,59)(H,51,61)(H,52,60)(H,57,58)/t28-,30+,31+,32+,33+,34+,36-,38+,39+/m1/s1

copy

InChIKey: KSVGOBQTQGOLQM-WBJGGQTMSA-N

copy

Source

Species Genus Family Order Class Phylum Kingdom Domain
Microcystis sp. Microcystis Microcystaceae Chroococcales Cyanophyceae Cyanobacteriota None Bacteria

Properties Information

Molecule Weight: 929.126

TPSA？: 313.42

MolLogP？: 4.822400000000012

Number of H-Donors: 8

Number of H-Acceptors: 12

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information