NCS
中国新化学物质查询
醋酸豆甾醇(Stigmasta-5,22-dien-3.beta.-ol, acetate)
豆甾醇乙酸酯, STIGMASTEROL ACETATE, 3beta-Acetoxystigmasta-5,22-diene, 3BETA-ACETOXY-5,22-STIGMASTADIENE, 3.β.-Acetoxystigmasta-5,22-diene, stigmasteryl acetate, Stigmasta-5,22-dien-3beta-ol,acetate, (22E)-Stigmasta-5,22-dien-3-yl acetate, Stigmasterol 3-Acetate, stigmasta-5,22-dien-3-acetate, Stigmasterolacetatecrystalline
CAS号: 4651-48-3
IUPAC名称: [(3S,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
分子式: C31H50O2
分子量: 454.72800
InChI: InChI=1S/C31H50O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h9-11,20-21,23,25-29H,8,12-19H2,1-7H3/b10-9+/t21-,23-,25+,26+,27-,28+,29+,30+,31-/m1/s1
InChIKey: IZEUIYYDWBKERE-ZRODXFKISA-N
SMILES: CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C)C(C)C
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