[D-Asp3,(E)-Dhb7]Microcystin HtyHty
AlkaPlorer ID: AK289441
Synonym: None
IUPAC Name: None
Structure
SMILES: C/C=C1/NC(=O)CCC(C(=O)O)NC(=O)C(C)C(/C=C/C(C)=C/C(C)C(CC2=CC=CC=C2)OC)NC(=O)C(CCC2=CC=C(O)C=C2)NC(=O)CC(C(=O)O)NC(=O)C(CCC2=CC=C(O)C=C2)NC(=O)C(C)NC1=O
InChI: InChI=1S/C56H71N7O14/c1-7-41-52(70)57-35(5)51(69)61-44(26-19-37-16-22-40(65)23-17-37)54(72)63-46(56(75)76)31-49(67)59-43(25-18-36-14-20-39(64)21-15-36)53(71)60-42(34(4)50(68)62-45(55(73)74)27-28-48(66)58-41)24-13-32(2)29-33(3)47(77-6)30-38-11-9-8-10-12-38/h7-17,20-24,29,33-35,42-47,64-65H,18-19,25-28,30-31H2,1-6H3,(H,57,70)(H,58,66)(H,59,67)(H,60,71)(H,61,69)(H,62,68)(H,63,72)(H,73,74)(H,75,76)/b24-13+,32-29+,41-7+
InChIKey: DGGUSUVUIGDKFF-BSPMMXSKSA-N
Reference
CAS: 1078145-57-9
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Planktothrix rubescens | Planktothrix | Microcoleaceae | Oscillatoriales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 1066.2189999999998
TPSA？: 327.9899999999999
MolLogP？: 2.9974000000000087
Number of H-Donors: 11
Number of H-Acceptors: 12
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|