PFAS

全球PFAS筛查数据库

全球PFAS筛查数据库>查询结果

GCIS

全球化学品名录

具栖冬青苷(Pedunculoside)

长梗冬青苷, β-D-Glucopyranose, 1-O-[(3β)-3,19,23-trihydroxy-28-oxours-12-en-28-yl]-, Pedunculoside, 1-O-[(3Beta)-3,19,23-Trihydroxy-28-oxours-12-en-28-yl]-Beta-D-glucopyranose, 1-O-[(3β)-3,19,23-Trihydroxy-28-oxours-12-en-28-yl]-β-D-glucopyranose

CAS号: 42719-32-4

IUPAC名称: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1R,2R,4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-1,10-dihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

分子式: C36H58O10

分子量: 650.840

InChI: InChI=1S/C36H58O10/c1-19-9-14-36(30(43)46-29-27(42)26(41)25(40)21(17-37)45-29)16-15-33(4)20(28(36)35(19,6)44)7-8-23-31(2)12-11-24(39)32(3,18-38)22(31)10-13-34(23,33)5/h7,19,21-29,37-42,44H,8-18H2,1-6H3/t19-,21-,22-,23-,24+,25-,26+,27-,28-,29+,31+,32+,33-,34-,35-,36+/m1/s1

InChIKey: LARPFJIXBULVPK-FBAXZNBGSA-N

SMILES: C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@@]5(C)CO)O)C)C)[C@@H]2[C@]1(C)O)C)C(=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O

EINECS: -