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siroamide

PropertiesImageOccurences in reactions
MNX_IDMNXM1377886Image of MNXM1377886
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
formulaC42H40N5O15
charge-7
mass854.802
referencemetacycM:CPD-7907
InChIKeyYPXHREMQARDHRX-IOLLEQHBSA-G
InChIInChI=1S/C42H47N5O15/c1-41(17-33(43)48)24(6-10-37(55)56)30-16-32-42(2,18-40(61)62)23(5-9-36(53)54)29(46-32)14-27-21(11-38(57)58)19(3-7-34(49)50)25(44-27)13-26-20(4-8-35(51)52)22(12-39(59)60)28(45-26)15-31(41)47-30/h13-16,23-24,45-46H,3-12,17-18H2,1-2H3,(H2,43,48)(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)(H,61,62)/p-7/b25-13-,29-14-,31-15-,32-16-
SMILES[CH3:1][C:41]1([CH2:17][C:33](=[NH:43])[OH:48])[CH:24]([CH2:6][CH2:10][C:37](=[O:55])[OH:56])[c:30]2[cH:16][c:32]3[nH:46][c:29]([cH:14][c:27]4[n:44][c:25]([cH:13][c:26]5[c:20]([CH2:4][CH2:8][C:35](=[O:51])[OH:52])[c:22]([CH2:12][C:39](=[O:59])[OH:60])[c:28]([cH:15][c:31]1[n:47]2)[nH:45]5)[C:19]([CH2:3][CH2:7][C:34](=[O:49])[OH:50])=[C:21]4[CH2:11][C:38](=[O:57])[OH:58])[CH:23]([CH2:5][CH2:9][C:36](=[O:53])[OH:54])[C:42]3([CH3:2])[CH2:18][C:40](=[O:61])[OH:62]
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IdentifierDescription
metacyc.compound:CPD-7907
metacycM:CPD-7907
siroamide