**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

compound 0288620

Properties Image with InChI numbering Occurences in reactions MNX_ID MNXM1368766 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C48H70N10O13 charge -2 mass 995.145 reference envipathM:...ae17a84ba560 InChIKey OEFIOQXSSMHYOU-DTGSKHMDSA-L InChI InChI=1S/C48H72N10O13/c1-24(2)19-35-45(67)57-39(47(70)71)28(6)41(63)55-36(22-32(59)23-51-48(49)50)44(66)53-33(16-15-25(3)20-26(4)37(60)21-31-13-11-10-12-14-31)27(5)40(62)54-34(46(68)69)17-18-38(61)58(9)30(8)43(65)52-29(7)42(64)56-35/h10-16,20,24,26-29,32-37,39,59-60H,8,17-19,21-23H2,1-7,9H3,(H,52,65)(H,53,66)(H,54,62)(H,55,63)(H,56,64)(H,57,67)(H,68,69)(H,70,71)(H4,49,50,51)/p-2/b16-15+,25-20+/t26-,27-,28-,29+,32?,33-,34+,35-,36-,37-,39+/m0/s1 SMILES [CH3:1][CH:24]([CH3:2])[CH2:19][C@H:35]1[C:45]([OH:67])=[N:57][C@@H:39]([C:47](=[O:70])[OH:71])[C@H:28]([CH3:6])[C:41]([OH:63])=[N:55][C@@H:36]([CH2:22][CH:32]([CH2:23][NH:51][C:48](=[NH:49])[NH2:50])[OH:59])[C:44]([OH:66])=[N:53][C@@H:33](/[CH:16]=[CH:15]/[C:25]([CH3:3])=[CH:20]/[C@H:26]([CH3:4])[C@H:37]([CH2:21][c:31]2[cH:13][cH:11][cH:10][cH:12][cH:14]2)[OH:60])[C@H:27]([CH3:5])[C:40]([OH:62])=[N:54][C@@H:34]([C:46](=[O:68])[OH:69])[CH2:17][CH2:18][C:38](=[O:61])[N:58]([CH3:9])[C:30](=[CH2:8])[C:43]([OH:65])=[N:52][C@H:29]([CH3:7])[C:42]([OH:64])=[N:56]1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources

Identifier	Description
envipath:...ae17a84ba560 envipathM:...ae17a84ba560	compound 0288620
envipath:...5c8b9e6ed40d envipathM:...5c8b9e6ed40d	compound 0287733