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(5S,6E,11E,13S,15R,16R)-5,13,15,16-tetrahydroxy-11-(2-methoxy-2-oxoethylidene)-8,8-dimethyl-3,9-dioxoheptadec-6-enoyl-[BryB polyketide synthase]

Properties

Image

Occurences in reactions

MNX_ID

MNXM743938

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₃₆H₅₇N₃O₁₇PS*

charge

mass

reference

metacycM:Monobranched-Heptadecenoyl-BryB-PKS

InChIKey

InChI

SMILES

[13CH3:1][C:23]([CH:29]([CH2:21][O:57][P:59]([OH:54])(=[O:55])[O:58][CH2:22][C:38]([CH3:5])([CH3:6])[CH:35]([C:36](=[N:41][CH2:12][CH2:10][C:32](=[N:40][CH2:13][CH2:14][S:60][C:34]([CH2:20][C:28]([CH2:18][CH:26](/[CH:9]=[CH:11]/[C:37]([CH3:3])([CH3:4])[C:31]([CH2:16]/[C:25]([CH2:15][CH:27]([CH2:19][CH:30]([CH:24]([CH3:2])[OH:43])[OH:47])[OH:45])=[CH:17]/[C:33](=[O:50])[O:56][CH3:8])=[O:48])[OH:44])=[O:46])=[O:51])[OH:49])[OH:53])[OH:52])[NH:39][13CH3:7])=[O:42]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:Monobranched-Heptadecenoyl-BryB-PKS metacycM:Monobranched-Heptadecenoyl-BryB-PKS	(5S,6E,11E,13S,15R,16R)-5,13,15,16-tetrahydroxy-11-(2-methoxy-2-oxoethylidene)-8,8-dimethyl-3,9-dioxoheptadec-6-enoyl-[BryB polyketide synthase]