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(12S)-12-methyl-5,7,11,13,17-pentahydroxynonadec-2,8-dienoyl-[SpnE polyketide synthase]

Properties

Image

with InChI numbering

Occurences in reactions

MNX_ID

MNXM1381815

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

formula

C₃₄H₅₉N₃O₁₄PS*

charge

mass

reference

metacycM:12-Methyl-pentahydroxynonadec-2-8-dienoyl-SpnE

InChIKey

InChI

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:12-Methyl-pentahydroxynonadec-2-8-dienoyl-SpnE metacycM:12-Methyl-pentahydroxynonadec-2-8-dienoyl-SpnE	(12S)-12-methyl-5,7,11,13,17-pentahydroxynonadec-2,8-dienoyl-[SpnE polyketide synthase]