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compound 0188356

PropertiesImage
MNX_IDMNXM1193999 Image of MNXM1193999
referenceenvipathM:...82be32dfe7ef
formulaC37H62O10
global charge0
mol weight666.893
InChIKeyHUWOECZUPOKBJL-UHFFFAOYSA-N
InChIInChI=1S/C37H62O10/c38-26-20-15-10-8-6-4-2-1-3-5-7-9-13-18-25-34(42)45-30(28-40)29-44-33(41)24-17-14-11-12-16-22-31-36(46-31)35(43)37-32(47-37)23-19-21-27-39/h1-2,6,8,26,30-32,35-37,39-40,43H,3-5,7,9-25,27-29H2
SMILESO=CCCCC=CCC=CCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCC1OC1C(O)C1OC1CCCCO
MNX internals
InChI (mnx)InChI=1/C37H62O10/c38-26-20-15-10-8-6-4-2-1-3-5-7-9-13-18-25-34(42)45-30(28-40)29-44-33(41)24-17-14-11-12-16-22-31-36(46-31)35(43)37-32(47-37)23-19-21-27-39/h1-2,6,8,26,30-32,35-37,39-40,43H,3-5,7,9-25,27-29H2/b2-1?,8-6?/t30?,31?,32?,35?,36?,37? Image of MNXM1193999
SMILES (mnx)[CH:1](=[CH:2][CH2:4][CH:6]=[CH:8][CH2:10][CH2:15][CH2:20][CH:26]=[O:38])[CH2:3][CH2:5][CH2:7][CH2:9][CH2:13][CH2:18][CH2:25][C:34](=[O:42])[O:45][CH:30]([CH2:28][OH:40])[CH2:29][O:44][C:33]([CH2:24][CH2:17][CH2:14][CH2:11][CH2:12][CH2:16][CH2:22][CH:31]1[CH:36]([CH:35]([CH:37]2[CH:32]([CH2:23][CH2:19][CH2:21][CH2:27][OH:39])[O:47]2)[OH:43])[O:46]1)=[O:41]
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

envipath:...82be32dfe7ef
envipathM:...82be32dfe7ef
HUWOECZUPOKBJL-UHFFFAOYSA-N
compound 0188356