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Avermectin B2a

PropertiesImageOccurences in reactions
MNX_IDMNXM1364243Image of MNXM1364243
#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
formulaC48H74O15
charge0
mass891.105
referencechebi:29540
InChIKeyCWGATOJEFAKFBK-QJDTYEMPSA-N
InChIInChI=1S/C48H74O15/c1-11-24(2)43-28(6)35(49)22-47(63-43)21-33-18-32(62-47)16-15-26(4)42(25(3)13-12-14-31-23-56-45-40(50)27(5)17-34(46(52)59-33)48(31,45)53)60-39-20-37(55-10)44(30(8)58-39)61-38-19-36(54-9)41(51)29(7)57-38/h12-15,17,24-25,28-30,32-45,49-51,53H,11,16,18-23H2,1-10H3/b13-12+,26-15+,31-14+/t24?,25-,28-,29-,30-,32+,33-,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47-,48+/m0/s1
SMILES[CH3:1][CH2:11][CH:24]([CH3:2])[C@@H:43]1[C@@H:28]([CH3:6])[C@@H:35]([OH:49])[CH2:22][C@:47]2([CH2:21][C@@H:33]3[CH2:18][C@@H:32]([CH2:16]/[CH:15]=[C:26](\[CH3:4])[C@@H:42]([O:60][C@H:39]4[CH2:20][C@H:37]([O:55][CH3:10])[C@@H:44]([O:61][C@H:38]5[CH2:19][C@H:36]([O:54][CH3:9])[C@@H:41]([OH:51])[C@H:29]([CH3:7])[O:57]5)[C@H:30]([CH3:8])[O:58]4)[C@@H:25]([CH3:3])/[CH:13]=[CH:12]/[CH:14]=[C:31]4\[CH2:23][O:56][C@@H:45]5[C@H:40]([OH:50])[C:27]([CH3:5])=[CH:17][C@@H:34]([C:46](=[O:52])[O:59]3)[C@:48]45[OH:53])[O:62]2)[O:63]1
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Similar chemical compounds in external resources
IdentifierDescription
seed.compound:cpd08772
seedM:cpd08772
CHEBI:29540
chebi:29540
kegg.compound:C11975
keggC:C11975
Avermectin B2a
keggC:M_C11975
seedM:M_cpd08772
secondary/obsolete/fantasy identifier