FDA全球物质注册数据库(FDA Global Substance Registration System)
物质名称WITHACOAGULIN
异名/同义词(6R)-6-((1R)-1-((1S,3BR,9AR,9BS,11AR)-9A,11A-DIMETHYL-9-OXO-1H,2H,3BH,4H,6H,9H,9AH,9BH,10H,11H,11AH-CYCLOPENTA(A)PHENANTHREN-1-YL)-1-HYDROXYETHYL)-3-(HYDROXYMETHYL)-4-METHYL-5,6-DIHYDRO-2H-PYRAN-2-ONE
ERGOSTA-2,5,14,24-TETRAEN-26-OIC ACID, 20,22,27-TRIHYDROXY-1-OXO-, .DELTA.-LACTONE, (22R)-
WITHACOAGULIN
CAS登记号601479-14-5
物质唯一标识(Unique Ingredient Identifier)3DG8L7689J
分子式C28H36O5
国际化合物标识(International Chemical Identifier,InChI)ZKTNOURYQAESEW-ZOKBQHMGSA-N
SMILESC=1C([C@]2(C(CC1)=CC[C@@]3([C@@]2(CC[C@]4(C3=CC[C@@]4([C@@]([C@@]5(OC(C(=C(C5)C)CO)=O)[H])(C)O)[H])C)[H])[H])C)=O
分子结构式
欧洲化学品管理局注册号(ECHA)
成分类型INGREDIENT SUBSTANCE / chemical
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