LSM-5805

chemical compound

Wikidata entity: Q27166519

C₃₂H₄₀BrN₅O₅ (P274)

Quantities

P2067mass653.221

P233 canonical SMILES String CC(C)CC1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=C(NC7=CC=CC(=C67)C5=C4)Br)C)O ???
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
P2017 isomeric SMILES String CC(C)C[C@H]1C(=O)N2CCC[C@@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@H]5CC6=C(NC7=CC=CC(=C67)C5=C4)Br)C)O ???
P3364 stereoisomer of ... Q413581 (bromocriptine) bromocriptine
P3364 stereoisomer of ... Q82393823 ((5'alpha,8alpha)-2-Bromo-12'-hydroxy-5'-(2-methylpropyl)-3',6',18-trioxo-2'-(propan-2-yl)ergotaman) (5'alpha,8alpha)-2-Bromo-12'-hydroxy-5'-(2-methylpropyl)-3',6',18-trioxo-2'-(propan-2-yl)ergotaman
P279 subclass of ... Q27163583 (LSM-1670) LSM-1670
P279 subclass of ... Q27163679 (LSM-1817) LSM-1817
External Ids
P683ChEBI ID94726
P234InChIInChI=1S/C32H40BrN5O5/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39)/t18-,23+,24+,25-,31-,32+/m1/s1
P235InChIKeyOZVBMTJYIDMWIL-JVOFPJAOSA-N
P662PubChem CID73707474
P11089UniChem compound ID76696144

Why not click here or view trends?

log id: 5739228