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Coatline A

PropertiesImage
MNX_IDMNXM47409 Image of MNXM47409
referencelipidmapsM:LMPK12120566
formulaC21H24O10
global charge0
mol weight436.413
InChIKeyCSATWRZOLKGPRW-UHFFFAOYSA-N
InChIInChI=1S/C21H24O10/c22-8-14-18(28)19(29)20(30)21(31-14)15-12(24)6-5-11(17(15)27)16(26)13(25)7-9-1-3-10(23)4-2-9/h1-6,13-14,18-25,27-30H,7-8H2
SMILESO=C(C1=CC=C(O)C(C2OC(CO)C(O)C(O)C2O)=C1O)C(O)CC1=CC=C(O)C=C1
MNX internals
InChI (mnx)InChI=1/C21H24O10/c22-8-14-18(28)19(29)20(30)21(31-14)15-12(24)6-5-11(17(15)27)16(26)13(25)7-9-1-3-10(23)4-2-9/h1-6,13-14,18-25,27-30H,7-8H2/t13?,14?,18?,19?,20?,21? Image of MNXM47409
SMILES (mnx)[CH:1]1=[CH:3][C:10]([OH:23])=[CH:4][CH:2]=[C:9]1[CH2:7][CH:13]([C:16]([C:11]1=[C:17]([OH:27])[C:15]([CH:21]2[CH:20]([OH:30])[CH:19]([OH:29])[CH:18]([OH:28])[CH:14]([CH2:8][OH:22])[O:31]2)=[C:12]([OH:24])[CH:6]=[CH:5]1)=[O:26])[OH:25]
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
IdentifierDescription

lipidmaps:LMPK12120566
lipidmapsM:LMPK12120566
CSATWRZOLKGPRW-UHFFFAOYSA-N 		Coatline A