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杜鹃毒素
grayanotoxin I
acteylandromedol, asebotoxin, rhodotoxine, GRAYANOTOXIN 1, ANDROMEDOTOXIN, acetylandromedol, acetyllandromedol, g-i, Grayanotoxin-I, rhodotoxin
CAS号: 4720-09-6
IUPAC名称: [(1S,3R,4R,6S,8S,9R,10R,13R,14R,16R)-3,4,6,9,14-pentahydroxy-5,5,9,14-tetramethyl-16-tetracyclo[11.2.1.01,10.04,8]hexadecanyl] acetate
分子式: C22H36O7
分子量: 412.51700
InChI: InChI=1S/C22H36O7/c1-11(23)29-17-12-6-7-13-20(5,27)14-8-15(24)18(2,3)22(14,28)16(25)9-21(13,17)10-19(12,4)26/h12-17,24-28H,6-10H2,1-5H3/t12-,13+,14+,15+,16-,17-,19-,20-,21+,22+/m1/s1
InChIKey: NXCYBYJXCJWMRY-VGBBEZPXSA-N
SMILES: CC(=O)O[C@@H]1[C@H]2CC[C@@H]3[C@]1(C[C@H]([C@]4([C@H]([C@]3(C)O)C[C@@H](C4(C)C)O)O)O)C[C@@]2(C)O
EINECS: -
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