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bhas#30

PropertiesImage
MNX_IDMNXM152804 Image of MNXM152804
referencechebi:79235
formulaC23H44O7
global charge0
mol weight432.598
InChIKeyMUVQYJIVDRBMJO-XBTHPWMNSA-N
InChIInChI=1S/C23H44O7/c1-17(29-23-21(26)16-20(25)18(2)30-23)13-11-9-7-5-3-4-6-8-10-12-14-19(24)15-22(27)28/h17-21,23-26H,3-16H2,1-2H3,(H,27,28)/t17-,18+,19-,20-,21-,23-/m1/s1
SMILESC[C@H](CCCCCCCCCCCC[C@@H](O)CC(=O)O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
MNX internals
InChI (mnx)InChI=1/C23H44O7/c1-17(29-23-21(26)16-20(25)18(2)30-23)13-11-9-7-5-3-4-6-8-10-12-14-19(24)15-22(27)28/h17-21,23-26H,3-16H2,1-2H3,(H,27,28)/t17-,18+,19-,20-,21-,23-/m1/s1 Image of MNXM152804
SMILES (mnx)[CH3:1][C@H:17]([CH2:13][CH2:11][CH2:9][CH2:7][CH2:5][CH2:3][CH2:4][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][C@H:19]([CH2:15][C:22](=[O:27])[OH:28])[OH:24])[O:29][C@H:23]1[C@H:21]([OH:26])[CH2:16][C@@H:20]([OH:25])[C@H:18]([CH3:2])[O:30]1
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

CHEBI:79235
chebi:79235
MUVQYJIVDRBMJO-XBTHPWMNSA-N 		bhas#30
(3R,16R)-16-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]-3-hydroxyheptadecanoic acid
3R-hydroxy-16R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-heptadecanoic acid

CHEBI:139753
chebi:139753
MUVQYJIVDRBMJO-XBTHPWMNSA-M 		bhas#30(1-)

lipidmaps:LMFA13040046
lipidmapsM:LMFA13040046
MUVQYJIVDRBMJO-XBTHPWMNSA-N 		bhas#30
3R-hydroxy-16R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-heptadecanoic acid
3R-hydroxy-16R-(3,6-dideoxy-alpha-L-arabino-hexopyranosyloxy)-heptadecanoic acid