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3',4'-Dihydrorhodovibrin

PropertiesImage
MNX_IDMNXM6766 Image of MNXM6766
referencechebi:80153
formulaC41H62O2
global charge0
mol weight586.945
InChIKeyHZZSQEYTDMZTNV-LPPVHDQUSA-N
InChIInChI=1S/C41H62O2/c1-34(22-14-24-36(3)26-16-28-38(5)30-18-32-40(7,8)42)20-12-13-21-35(2)23-15-25-37(4)27-17-29-39(6)31-19-33-41(9,10)43-11/h12-17,20-29,42H,18-19,30-33H2,1-11H3/b13-12+,22-14+,23-15+,26-16+,27-17+,34-20+,35-21+,36-24+,37-25+,38-28+,39-29+
SMILESCOC(C)(C)CCC/C(C)=C/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(\C)CCCC(C)(C)O
MNX internals
InChI (mnx)InChI=1/C41H62O2/c1-34(22-14-24-36(3)26-16-28-38(5)30-18-32-40(7,8)42)20-12-13-21-35(2)23-15-25-37(4)27-17-29-39(6)31-19-33-41(9,10)43-11/h12-17,20-29,42H,18-19,30-33H2,1-11H3/b13-12+,22-14+,23-15+,26-16+,27-17+,34-20+,35-21+,36-24+,37-25+,38-28+,39-29+ Image of MNXM6766
SMILES (mnx)[CH3:1][C:34](=[CH:20]\[CH:12]=[CH:13]\[CH:21]=[C:35]([CH3:2])\[CH:23]=[CH:15]\[CH:25]=[C:37]([CH3:4])\[CH:27]=[CH:17]\[CH:29]=[C:39](/[CH3:6])[CH2:31][CH2:19][CH2:33][C:41]([CH3:9])([CH3:10])[O:43][CH3:11])/[CH:22]=[CH:14]/[CH:24]=[C:36]([CH3:3])/[CH:26]=[CH:16]/[CH:28]=[C:38](\[CH3:5])[CH2:30][CH2:18][CH2:32][C:40]([CH3:7])([CH3:8])[OH:42]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd14618
seedM:cpd14618
CHEBI:80153
chebi:80153
kegg.compound:C15887
keggC:C15887
lipidmaps:LMPR01070139
lipidmapsM:LMPR01070139
HZZSQEYTDMZTNV-LPPVHDQUSA-N
3',4'-Dihydrorhodovibrin

vmhM:34dhrdvn
vmhmetabolite:34dhrdvn
HZZSQEYTDMZTNV-LPPVHDQUSA-N
3,4-Dihydrorhodovibrin

keggC:M_C15887
seedM:M_cpd14618
vmhM:M_34dhrdvn
secondary/obsolete/fantasy identifier