Spumigin I
AlkaPlorer ID: AK002487
Synonym: ''
IUPAC Name: N-[5-(diaminomethylideneamino)-1-hydroxypentan-2-yl]-1-[(2S)-2-[[(2R)-2-hydroxy-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carboxamide
Structure
SMILES: CC(C)C[C@H](N=C(O)[C@H](O)CC1=CC=C(O)C=C1)C(=O)N1CCCC1C(O)=NC(CO)CCCNC(=N)N
InChI: InChI=1S/C26H42N6O6/c1-16(2)13-20(31-24(37)22(35)14-17-7-9-19(34)10-8-17)25(38)32-12-4-6-21(32)23(36)30-18(15-33)5-3-11-29-26(27)28/h7-10,16,18,20-22,33-35H,3-6,11-15H2,1-2H3,(H,30,36)(H,31,37)(H4,27,28,29)/t18?,20-,21?,22+/m0/s1
InChIKey: KCGHIZDUEPNSKV-CFBBYLOMSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Nodularia harveyana | Nodularia | Aphanizomenonaceae | Nostocales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 534.6580000000004
TPSA？: 208.08
MolLogP？: 1.2384700000000022
Number of H-Donors: 8
Number of H-Acceptors: 7
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|