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Cholestane-3b,5a,6b,(25R)26-tetrol

PropertiesImage
MNX_IDMNXM1131844 Image of MNXM1131844
referencelipidmapsM:LMST01010458
formulaC27H48O4
global charge0
mol weight436.677
InChIKeyPFYSRSDOSXYIFG-JKYVJSSTSA-N
InChIInChI=1S/C27H48O4/c1-17(16-28)6-5-7-18(2)21-8-9-22-20-14-24(30)27(31)15-19(29)10-13-26(27,4)23(20)11-12-25(21,22)3/h17-24,28-31H,5-16H2,1-4H3/t17-,18-,19+,20+,21-,22+,23+,24-,25-,26-,27+/m1/s1
SMILESC[C@@H](CO)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@@H](O)[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
MNX internals
InChI (mnx)InChI=1/C27H48O4/c1-17(16-28)6-5-7-18(2)21-8-9-22-20-14-24(30)27(31)15-19(29)10-13-26(27,4)23(20)11-12-25(21,22)3/h17-24,28-31H,5-16H2,1-4H3/t17-,18-,19+,20+,21-,22+,23+,24-,25-,26-,27+/m1/s1 Image of MNXM1131844
SMILES (mnx)[CH3:1][C@H:17]([CH2:6][CH2:5][CH2:7][C@@H:18]([CH3:2])[C@H:21]1[CH2:8][CH2:9][C@H:22]2[C@@H:20]3[CH2:14][C@@H:24]([OH:30])[C@@:27]4([OH:31])[CH2:15][C@@H:19]([OH:29])[CH2:10][CH2:13][C@:26]4([CH3:4])[C@H:23]3[CH2:11][CH2:12][C@:25]12[CH3:3])[CH2:16][OH:28]
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:LMST01010458
lipidmapsM:LMST01010458
PFYSRSDOSXYIFG-JKYVJSSTSA-N 		Cholestane-3b,5a,6b,(25R)26-tetrol
Cholestane-3b,5a,6b,(25R)26-tetrol
O4
ST 27:0

lipidmaps:LMST01010582
lipidmapsM:LMST01010582
PFYSRSDOSXYIFG-DUNVRISLSA-N 		27-hydroxy-cholestanetriol
27H-CT
Cholestan-3beta,5alpha,6beta,27-tetraol
O4
ST 27:0

CHEBI:233823
chebi:233823
PFYSRSDOSXYIFG-DUNVRISLSA-N 		Cholestane-3,5,6,26-tetrol
(1R,3aS,3bS,5R,5aR,7S,9aR,9bS,11aR)-1-[(2R)-7-hydroxy-6-methylheptan-2-yl]-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthrene-5,5a,7-triol