[(4S,4aS,5S,6S,8aS)-5-hydroxy-6-[(1S)-1-[(2-methoxyethyl)carbamoyl]ethyl]-4,8a-dimethyl-4H,4aH,5H,6H,7H,8H,9H-naphtho[2,3-d][1,3]thiazol-2-yl]methyl 2,2-dimethylpropanoate
AlkaPlorer ID: AK250137
Synonym: None
IUPAC Name: [(4R,4aS,5S,6R,8aR)-5-hydroxy-6-[(2S)-1-(2-methoxyethylamino)-1-oxopropan-2-yl]-4,8a-dimethyl-4a,5,6,7,8,9-hexahydro-4H-benzo[f][1,3]benzothiazol-2-yl]methyl 2,2-dimethylpropanoate
Structure
SMILES: COCCNC(=O)[C@@H](C)[C@H]1CC[C@]2(C)CC3=C(N=C(COC(=O)C(C)(C)C)S3)[C@H](C)[C@@H]2[C@H]1O
InChI: InChI=1S/C25H40N2O5S/c1-14(22(29)26-10-11-31-7)16-8-9-25(6)12-17-20(15(2)19(25)21(16)28)27-18(33-17)13-32-23(30)24(3,4)5/h14-16,19,21,28H,8-13H2,1-7H3,(H,26,29)/t14-,15+,16+,19+,21-,25+/m0/s1
InChIKey: VBEGUXUWUNPSPJ-PKCISXGASA-N
Reference
PubChem CID: 162820388
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 480.6710000000002
TPSA？: 97.75
MolLogP？: 3.684100000000003
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|