gs-9256
chemical compound
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gs-9256
Summary
gs-9256 is a group of stereoisomers[1].
Key Facts
- gs-9256's instance of is recorded as group of stereoisomers[2].
- gs-9256's CAS Registry Number is recorded as 1001094-46-7[3].
- gs-9256's canonical SMILES is recorded as CC(C)NC1=NC(=CS1)C2=NC3=C(C=CC(=C3Cl)OC)C(=C2)OC4CC5C(=O)NC6(CC6CCCCCCCC(C(=O)N5C4)NC(=O)OC7CCCC7)P(=O)(CC8=C(C=CC=C8F)F)O[4].
- gs-9256's InChI is recorded as InChI=1S/C46H56ClF2N6O8PS/c1-26(2)50-44-52-36(25-65-44)35-21-39(30-18-19-38(61-3)40(47)41(30)51-35)62-29-20-37-42(56)54-46(64(59,60)24-31-32(48)15-11-16-33(31)49)22-27(46)12-7-5-4-6-8-17-34(43(57)55(37)23-29)53-45(58)63-28-13-9-10-14-28/h11,15-16,18-19,21,25-29,34,37H,4-10,12-14,17,20,22-24H2,1-3H3,(H,50,52)(H,53,58)(H,54,56)(H,59,60)/t27-,29-,34+,37+,46+/m1/s1[5].
- gs-9256's InChIKey is recorded as RFGUWOCFYCYEDM-ZOMNBDOOSA-N[6].
- gs-9256's chemical formula is recorded as C₄₆H₅₆ClF₂N₆O₈PS[7].
- gs-9256's subclass of is recorded as chemical compound[8].
- gs-9256's ChEMBL ID is recorded as CHEMBL1956820[9].
- gs-9256's UNII is recorded as 8V42Y78HRU[10].
- gs-9256's ChemSpider ID is recorded as 28497303[11].
- gs-9256's PubChem CID is recorded as 24823649[12].
- gs-9256's DrugBank ID is recorded as DB12876[13].
- gs-9256's isomeric SMILES is recorded as CC(C)NC1=NC(=CS1)C2=NC3=C(C=CC(=C3Cl)OC)C(=C2)O[C@@H]4C[C@H]5C(=O)N[C@@]6(C[C@H]6CCCCCCCC@@HNC(=O)OC7CCCC7)P(=O)(CC8=C(C=CC=C8F)F)OC@@HNC(=O)OC7CCCC7)P(=O)(CC8=C(C=CC=C8F)F)O">[14].
- gs-9256's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+956.327'}[15].
- gs-9256's SureChEMBL ID is recorded as 9987287[16].
- gs-9256's DSSTox substance ID is recorded as DTXSID70142946[17].
- gs-9256's DSSTOX compound identifier is recorded as DTXCID5065437[18].
- gs-9256's UniChem compound ID is recorded as 27205814[19].
- gs-9256's Probes And Drugs ID is recorded as PD058401[20].