(3R,4S,5S,6R,7R,9R,10E,11S,12R,13S,14R)-6-[4-(Dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-10-(2-methoxyethoxymethoxyimino)-3,5,7,9,11,13-hexamethyl-oxacyclotetradecan-2-one

Properties Image MNX_ID MNXM1364521 reference chebi:181408 formula C41H76N2O15 global charge 0 mol weight 837.058 InChIKey RXZBMPWDPOLZGW-KMAKEOJNSA-N InChI InChI=1S/C41H76N2O15/c1-15-29-41(10,49)34(45)24(4)31(42-53-21-52-17-16-50-13)22(2)19-39(8,48)36(58-38-32(44)28(43(11)12)18-23(3)54-38)25(5)33(26(6)37(47)56-29)57-30-20-40(9,51-14)35(46)27(7)55-30/h22-30,32-36,38,44-46,48-49H,15-21H2,1-14H3/b42-31+/t22-,23?,24+,25+,26-,27?,28?,29-,30?,32?,33+,34-,35?,36-,38?,39-,40?,41-/m1/s1 SMILES CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2CC(C)(OC)C(O)C(C)O2)[C@H](C)[C@@H](OC2OC(C)CC(N(C)C)C2O)[C@](C)(O)C[C@@H](C)/C(=N\OCOCCOC)[C@H](C)[C@@H](O)[C@]1(C)O MNX internals InChI (mnx) InChI=1/C41H76N2O15/c1-15-29-41(10,49)34(45)24(4)31(42-53-21-52-17-16-50-13)22(2)19-39(8,48)36(58-38-32(44)28(43(11)12)18-23(3)54-38)25(5)33(26(6)37(47)56-29)57-30-20-40(9,51-14)35(46)27(7)55-30/h22-30,32-36,38,44-46,48-49H,15-21H2,1-14H3/b42-31+/t22-,23?,24+,25+,26-,27?,28?,29-,30?,32?,33+,34-,35?,36-,38?,39-,40?,41-/m1/s1 SMILES (mnx) [CH3:1][CH2:15][C@@H:29]1[C@@:41]([CH3:10])([OH:49])[C@H:34]([OH:45])[C@@H:24]([CH3:4])/[C:31](=[N:42]/[O:53][CH2:21][O:52][CH2:17][CH2:16][O:50][CH3:13])[C@H:22]([CH3:2])[CH2:19][C@@:39]([CH3:8])([OH:48])[C@H:36]([O:58][CH:38]2[CH:32]([OH:44])[CH:28]([N:43]([CH3:11])[CH3:12])[CH2:18][CH:23]([CH3:3])[O:54]2)[C@@H:25]([CH3:5])[C@H:33]([O:57][CH:30]2[CH2:20][C:40]([CH3:9])([O:51][CH3:14])[CH:35]([OH:46])[CH:27]([CH3:7])[O:55]2)[C@@H:26]([CH3:6])[C:37](=[O:47])[O:56]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0