Rhodovibrin

Properties Image MNX_ID MNXM5919 reference chebi:80149 formula C41H60O2 global charge 0 mol weight 584.929 InChIKey CGEVWQFVGBQXOA-WQMGISBJSA-N InChI InChI=1S/C41H60O2/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/h12-17,19-29,31,42H,18,30,32-33H2,1-11H3/b13-12+,22-14+,23-15+,26-16+,27-17+,31-19+,34-20+,35-21+,36-24+,37-25+,38-28+,39-29+ SMILES COC(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)/C=C/C=C(\C)CCCC(C)(C)O MNX internals InChI (mnx) InChI=1/C41H60O2/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/h12-17,19-29,31,42H,18,30,32-33H2,1-11H3/b13-12+,22-14+,23-15+,26-16+,27-17+,31-19+,34-20+,35-21+,36-24+,37-25+,38-28+,39-29+ 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])\[CH:31]=[CH: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) 4 in models (compartimentalized) 0