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avermectin B1a

PropertiesImageOccurences in reactions
MNX_IDMNXM1105865Image of MNXM1105865
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
formulaC48H72O14
charge0
mass872.49221
referencechebi:29534
InChIKeyRRZXIRBKKLTSOM-XPNPUAGNSA-N
InChIInChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12+,27-15+,32-14+/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1
SMILESCC[C@H](C)[C@H]1O[C@]2(C=C[C@@H]1C)C[C@@H]1C[C@@H](C/C=C(\C)[C@@H](O[C@H]3C[C@H](OC)[C@@H](O[C@H]4C[C@H](OC)[C@@H](O)[C@H](C)O4)[C@H](C)O3)[C@@H](C)/C=C/C=C3\CO[C@@H]4[C@H](O)C(C)=C[C@@H](C(=O)O1)[C@]34O)O2
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Similar chemical compounds in external resources
IdentifierDescription
CHEBI:29534
chebi:29534 		avermectin B1a
(2aE,4E,5'S,6S,6'R,7S,8E,11R,13S,15S,17aR,20R,20aR,20bS)-20,20b-dihydroxy-5',6,8,19-tetramethyl-6'-[(1S)-1-methylpropyl]-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranosyl)-3-O-methyl-alpha-L-arabino-hexopyranoside
Avermectin B1a
abamectin component B1a
envipath:...8f93e9201247
envipathM:...8f93e9201247
envipath:...739b94451e41
envipathM:...739b94451e41
kegg.compound:C11983
keggC:C11983
lipidmaps:LMPK04000024
lipidmapsM:LMPK04000024 		Avermectin B1a
seed.compound:cpd08780
seedM:cpd08780 		Avermectin B1a
avermectin B1a
metacyc.compound:CPD-12963
metacycM:CPD-12963 		avermectin B1a
keggC:M_C11983
seedM:M_cpd08780 		secondary/obsolete/fantasy identifier