MSI_000012297

Unavailable

排名分数: -1.27
参考来源: Bathymodiolus (UBERON:2000211: gill lamella)

M/z: 791.3582
Mass Window: 791.3582 ~ 791.3582 (0.0 ppm)

参考注释

(1r,1's,2s,2's,3's,4s,5'r,6s,7s,8r,8'r,9's,11's,13s,13's,14s,14's,15s,15'r,17s,21s)-3'-(acetyloxy)-6,7,13',14'-tetrahydroxy-9,9,16',16'-tetramethyl-7'-oxo-3,5,10',12',22-pentaoxaspiro[heptacyclo[12.9.0.0¹,⁶.0²,¹⁷.0⁴,¹³.0⁸,¹³.0¹⁸,²³]tricosane-21,6'-hexacyclo[9.8.0.0¹,¹⁵.0²,⁸.0⁵,⁹.0⁸,¹³]nonadecan]-18(23)-en-15-yl acetate_[M+H-H2O]+ (BioDeep_00002082227)
(1r,1's,2s,2's,3's,4s,5'r,6s,7s,8r,8'r,9's,11's,13s,13's,14s,14's,15s,15'r,17s,21s)-3'-(acetyloxy)-6,7,13',14'-tetrahydroxy-9,9,16',16'-tetramethyl-7'-oxo-3,5,10',12',22-pentaoxaspiro[heptacyclo[12.9.0.0¹,⁶.0²,¹⁷.0⁴,¹³.0⁸,¹³.0¹⁸,²³]tricosane-21,6'-hexacyclo[9.8.0.0¹,¹⁵.0²,⁸.0⁵,⁹.0⁸,¹³]nonadecan]-18(23)-en-15-yl acetate

Formula: C44H56O14 (808.3669876)
SMILES:

CC(=O)O[C@H]1C[C@@H]2[C@@H]3O[C@H]4O[C@]5(O)[C@@H](O)[C@@H]6C(C)(C)CCC[C@]46[C@H]1[C@]35C(=O)[C@]21CCC2=C(O1)[C@@]13[C@H]4O[C@H]5O[C@]1(O)[C@@H](O)[C@@H]1C(C)(C)CCC[C@]51[C@@H]3[C@@H](OC(C)=O)C[C@@H]24