**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

[CorL polyketide synthase] intermediate VII

Properties Image MNX_ID MNXM1562821 reference metacycM:CorL-Intermediate-VII formula C28H45N3O9PS*2 global charge -1 mol weight   InChIKey   InChI   SMILES [*]N[C@@H](COP(=O)([O-])OCC(C)(C)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)/C=C(\C)CCC/C(C)=C/C/C=C/C)C([*])=O MNX internals InChI (mnx) InChI=1/C30H52N3O9PS/c1-8-9-10-12-22(2)13-11-14-23(3)19-27(36)44-18-17-32-26(35)15-16-33-29(38)28(37)30(5,6)21-42-43(39,40)41-20-25(31-7)24(4)34/h8-9,12,19,25,28,31,37H,10-11,13-18,20-21H2,1-7H3,(H,32,35)(H,33,38)(H,39,40)/b9-8+,22-12+,23-19+/t25-,28-/m0/s1/i4+1,7+1 SMILES (mnx) [CH3:1]/[CH:6]=[13CH:7]\[CH2:8]/[CH:10]=[C:21](\[CH3:2])[CH2:11][CH2:9][CH2:12]/[C:22]([CH3:3])=[CH:17]/[C:25](=[O:34])[O:42][CH2:16][CH2:15][CH2:30][C:24]([CH2:13][CH2:14][NH:31][C:27]([C@H:26]([C:28]([13CH3:4])([CH3:5])[CH2:20][O:40][O:41]([OH:37])(=[O:38])[O:39][CH2:19][C@@H:23]([C:18](=[NH:32])[PH2:43])[CH2:29][SH:44])[OH:35])=[O:36])=[NH:33]

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

Identifier	Description
metacyc.compound:CorL-Intermediate-VII metacycM:CorL-Intermediate-VII	[CorL polyketide synthase] intermediate VII (2E,7E,10E)-3,7-dimethyldodeca-2,7,10-trienoyl-[CorL PKS]