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1-(O-alpha-D-glucopyranosyl)-3-keto-(1,25R)-hexacosanediol

PropertiesImage
MNX_IDMNXM27194 Image of MNXM27194
referencelipidmapsM:LMFA13010020
formulaC32H62O8
global charge0
mol weight574.84
InChIKeyZAOCREGSHHBKIE-JJPWUKMOSA-N
InChIInChI=1S/C32H62O8/c1-26(34)21-19-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20-22-27(35)23-24-39-32-31(38)30(37)29(36)28(25-33)40-32/h26,28-34,36-38H,2-25H2,1H3/t26-,28-,29-,30+,31-,32+/m1/s1
SMILESC[C@@H](O)CCCCCCCCCCCCCCCCCCCCCC(=O)CCO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C32H62O8/c1-26(34)21-19-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20-22-27(35)23-24-39-32-31(38)30(37)29(36)28(25-33)40-32/h26,28-34,36-38H,2-25H2,1H3/t26-,28-,29-,30+,31-,32+/m1/s1 Image of MNXM27194
SMILES (mnx)[CH3:1][C@H:26]([CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH2:5][CH2:3][CH2:2][CH2:4][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][CH2:22][C:27]([CH2:23][CH2:24][O:39][C@@H:32]1[C@H:31]([OH:38])[C@@H:30]([OH:37])[C@H:29]([OH:36])[C@@H:28]([CH2:25][OH:33])[O:40]1)=[O:35])[OH:34]
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:LMFA13010020
lipidmapsM:LMFA13010020
ZAOCREGSHHBKIE-JJPWUKMOSA-N
1-(O-alpha-D-glucopyranosyl)-3-keto-(1,25R)-hexacosanediol
1-(O-alpha-D-glucopyranosyl)-3-keto-(1,25R)-hexacosanediol

CHEBI:201072
chebi:201072
ZAOCREGSHHBKIE-PHBKHABKSA-N
1-(O-alpha-D-Glucopyranosyl)-3-keto-25R-hexacosanol
(25R)-25-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexacosan-3-one