C27-mycolipanoate

Properties Image MNX_ID MNXM164622 reference metacycM:CPD-18583 formula C27H53O2 global charge -1 mol weight 409.719 InChIKey CHPNWWIYWJBRKU-GSDHBNRESA-M InChI InChI=1S/C27H54O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(2)22-25(3)23-26(4)27(28)29/h24-26H,5-23H2,1-4H3,(H,28,29)/p-1/t24-,25-,26-/m0/s1 SMILES CCCCCCCCCCCCCCCCCC[C@H](C)C[C@H](C)C[C@H](C)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C27H54O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(2)22-25(3)23-26(4)27(28)29/h24-26H,5-23H2,1-4H3,(H,28,29)/t24-,25-,26-/m0/s1 SMILES (mnx) [CH3:1][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][C@H:24]([CH3:2])[CH2:22][C@H:25]([CH3:3])[CH2:23][C@H:26]([CH3:4])[C:27](=[O:28])[OH:29]

Parent-child relations graph

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