1,1'-dihydroxy-1,1',2,2'-tetrahydroneurosporene

Properties Image MNX_ID MNXM13812 reference chebi:138076 formula C40H62O2 global charge 0 mol weight 574.934 InChIKey YBUVIHJIZVAODP-ZDVIUYNHSA-N InChI InChI=1S/C40H62O2/c1-33(21-13-23-35(3)25-15-27-37(5)29-17-31-39(7,8)41)19-11-12-20-34(2)22-14-24-36(4)26-16-28-38(6)30-18-32-40(9,10)42/h11-15,19-25,27-28,41-42H,16-18,26,29-32H2,1-10H3/b12-11+,21-13+,22-14+,25-15+,33-19+,34-20+,35-23+,36-24+,37-27+,38-28+ SMILES CC(/C=C/C=C(C)/C=C/C=C(\C)CCCC(C)(C)O)=C\C=C\C=C(C)\C=C\C=C(/C)CC/C=C(\C)CCCC(C)(C)O MNX internals InChI (mnx) InChI=1/C40H62O2/c1-33(21-13-23-35(3)25-15-27-37(5)29-17-31-39(7,8)41)19-11-12-20-34(2)22-14-24-36(4)26-16-28-38(6)30-18-32-40(9,10)42/h11-15,19-25,27-28,41-42H,16-18,26,29-32H2,1-10H3/b12-11+,21-13+,22-14+,25-15+,33-19+,34-20+,35-23+,36-24+,37-27+,38-28+ SMILES (mnx) [CH3:1][C:33](=[CH:19]\[CH:11]=[CH:12]\[CH:20]=[C:34]([CH3:2])\[CH:22]=[CH:14]\[CH:24]=[C:36](/[CH3:4])[CH2:26][CH2:16]/[CH:28]=[C:38](\[CH3:6])[CH2:30][CH2:18][CH2:32][C:40]([CH3:9])([CH3:10])[OH:42])/[CH:21]=[CH:13]/[CH:23]=[C:35]([CH3:3])/[CH:25]=[CH:15]/[CH:27]=[C:37](\[CH3:5])[CH2:29][CH2:17][CH2:31][C:39]([CH3:7])([CH3:8])[OH:41]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0