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compound 0288234

PropertiesImageOccurences in reactions
MNX_IDMNXM1369081Image of MNXM1369081
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC49H74N10O13
charge-2
mass1011.188
referenceenvipathM:...c48d88436c38
InChIKeyFESRTSUROMUXNI-UHFFFAOYSA-L
InChIInChI=1S/C49H76N10O13/c1-25(2)22-35-45(66)57-39(48(70)71)29(6)42(63)58-40(36(60)20-21-52-49(50)51)46(67)54-33(17-16-26(3)23-27(4)37(72-10)24-32-14-12-11-13-15-32)28(5)41(62)55-34(47(68)69)18-19-38(61)59(9)31(8)44(65)53-30(7)43(64)56-35/h11-17,25-30,33-37,39-40,60H,8,18-24H2,1-7,9-10H3,(H,53,65)(H,54,67)(H,55,62)(H,56,64)(H,57,66)(H,58,63)(H,68,69)(H,70,71)(H4,50,51,52)/p-2
SMILES[CH3:1][CH:25]([CH3:2])[CH2:22][CH:35]1[C:45]([OH:66])=[N:57][CH:39]([C:48](=[O:70])[OH:71])[CH:29]([CH3:6])[C:42]([OH:63])=[N:58][CH:40]([CH:36]([CH2:20][CH2:21][NH:52][C:49](=[NH:50])[NH2:51])[OH:60])[C:46]([OH:67])=[N:54][CH:33]([CH:17]=[CH:16][CH:26]([CH3:3])[CH2:23][CH:27]([CH3:4])[CH:37]([CH2:24][c:32]2[cH:14][cH:12][cH:11][cH:13][cH:15]2)[O:72][CH3:10])[CH:28]([CH3:5])[C:41]([OH:62])=[N:55][CH:34]([C:47](=[O:68])[OH:69])[CH2:18][CH2:19][C:38](=[O:61])[N:59]([CH3:9])[C:31](=[CH2:8])[C:44]([OH:65])=[N:53][CH:30]([CH3:7])[C:43]([OH:64])=[N:56]1
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IdentifierDescription
envipath:...c48d88436c38
envipathM:...c48d88436c38
compound 0288234