Sandarazol B
AlkaPlorer ID: AK328310
Synonym: None
IUPAC Name: (E)-N-[(2R)-3-(dimethylamino)-1-[[(2S)-1-[(2S)-3-hydroxy-4-methyl-2-(2-methylpropyl)-5-oxo-2H-pyrrol-1-yl]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]-4-[(2R,3R)-3-(3-methylbutanoyl)oxiran-2-yl]but-3-enamide
Structure
SMILES: CC1=C(O)[C@H](CC(C)C)N(C(=O)[C@@H](NC(=O)[C@@H](CN(C)C)NC(=O)C/C=C/[C@H]2O[C@H]2C(=O)CC(C)C)C(C)C)C1=O
InChI: InChI=1S/C30H48N4O7/c1-16(2)13-21-26(37)19(7)29(39)34(21)30(40)25(18(5)6)32-28(38)20(15-33(8)9)31-24(36)12-10-11-23-27(41-23)22(35)14-17(3)4/h10-11,16-18,20-21,23,25,27,37H,12-15H2,1-9H3,(H,31,36)(H,32,38)/b11-10+/t20-,21+,23-,25+,27+/m1/s1
InChIKey: NCWVJEQGGQXPMK-DYGKSLOVSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Sandaracinus sp. | Sandaracinus | Sandaracinaceae | Polyangiales | None | Myxococcota | None | Bacteria |
Properties Information
Molecule Weight: 576.7350000000002
TPSA？: 148.64999999999998
MolLogP？: 2.118000000000004
Number of H-Donors: 3
Number of H-Acceptors: 8
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|