MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

Feedback

Amylose

	Properties	Image
MNX_ID	MNXM1105025
reference	hmdb:HMDB0003403
formula	C₁₄H₂₆O₁₁
global charge	0
mol weight	370.351
InChIKey	PTHCMJGKKRQCBF-OLYDTGNASA-N
InChI	InChI=1S/C14H26O11/c1-21-11-5(3-15)24-14(10(20)7(11)17)25-12-6(4-16)23-13(22-2)9(19)8(12)18/h5-20H,3-4H2,1-2H3/t5-,6-,7-,8-,9-,10-,11-,12-,13+,14-/m1/s1
SMILES	CO[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](OC)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O

MNX internals

InChI (mnx)	InChI=1/C14H26O11/c1-21-11-5(3-15)24-14(10(20)7(11)17)25-12-6(4-16)23-13(22-2)9(19)8(12)18/h5-20H,3-4H2,1-2H3/t5-,6-,7-,8-,9-,10-,11-,12-,13+,14-/m1/s1
SMILES (mnx)	[CH3:1][O:21][C@@H:11]1[C@@H:5]([CH2:3][OH:15])[O:24][C@H:14]([O:25][C@@H:12]2[C@@H:6]([CH2:4][OH:16])[O:23][C@H:13]([O:22][CH3:2])[C@H:9]([OH:19])[C@H:8]2[OH:18])[C@H:10]([OH:20])[C@H:7]1[OH:17]

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0003403 PTHCMJGKKRQCBF-OLYDTGNASA-N	Amylose (1,4-alpha-D-Glucosyl)N (1,4-alpha-D-Glucosyl)N-1 (1,4-alpha-D-Glucosyl)n+1 (1,4-alpha-delta-Glucosyl)N (1,4-alpha-delta-Glucosyl)N-1 (1,4-alpha-delta-Glucosyl)n+1 1,4-alpha-D-Glucan 1,4-alpha-delta-Glucan 4-{(1,4)-alpha-D-glucosyl}(N-1)-D-glucose 4-{(1,4)-alpha-delta-glucosyl}(N-1)-delta-glucose Amylose chain a-D-Mannose alpha-D-mannose
hmdb:HMDB03403	secondary/obsolete/fantasy identifier