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compound 0288216

PropertiesImageOccurences in reactions
MNX_IDMNXM1368241Image of MNXM1368241
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC49H73N10O14
charge-3
mass1026.179
referenceenvipathM:...58aa460b4a3d
InChIKeyKABGHSDNZPVKJT-UHFFFAOYSA-K
InChIInChI=1S/C49H76N10O14/c1-26(2)22-37(58-43(65)31(7)54-42(64)30(6)52-8)46(68)59-40(48(71)72)33(25-60)44(66)56-35(16-13-21-53-49(50)51)45(67)55-34(29(5)41(63)57-36(47(69)70)19-20-39(61)62)18-17-27(3)23-28(4)38(73-9)24-32-14-11-10-12-15-32/h10-12,14-15,17-18,23,26,28-29,31,33-38,40,52,60H,6,13,16,19-22,24-25H2,1-5,7-9H3,(H,54,64)(H,55,67)(H,56,66)(H,57,63)(H,58,65)(H,59,68)(H,61,62)(H,69,70)(H,71,72)(H4,50,51,53)/p-3
SMILES[CH3:1][CH:26]([CH3:2])[CH2:22][CH:37]([C:46](=[N:59][CH:40]([CH:33]([CH2:25][OH:60])[C:44](=[N:56][CH:35]([CH2:16][CH2:13][CH2:21][NH:53][C:49](=[NH:50])[NH2:51])[C:45](=[N:55][CH:34]([CH:18]=[CH:17][C:27]([CH3:3])=[CH:23][CH:28]([CH3:4])[CH:38]([CH2:24][c:32]1[cH:14][cH:11][cH:10][cH:12][cH:15]1)[O:73][CH3:9])[CH:29]([CH3:5])[C:41](=[N:57][CH:36]([CH2:19][CH2:20][C:39](=[O:61])[OH:62])[C:47](=[O:69])[OH:70])[OH:63])[OH:67])[OH:66])[C:48](=[O:71])[OH:72])[OH:68])[N:58]=[C:43]([CH:31]([CH3:7])[N:54]=[C:42]([C:30](=[CH2:6])[NH:52][CH3:8])[OH:64])[OH:65]
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IdentifierDescription
envipath:...58aa460b4a3d
envipathM:...58aa460b4a3d
compound 0288216