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5beta-cholestane-3alpha,7alpha,12alpha,24S,25-pentol

PropertiesImage
MNX_IDMNXM1583574 Image of MNXM1583574
referencevmhM:xolteolh25oh
vmhM:xolteolh25oh
formulaC27H48O5
global charge0
mol weight452.676
InChIKeyNHPWQASMMFUHIZ-KHGJHHBHSA-N
InChIInChI=1S/C27H48O5/c1-15(6-9-22(30)25(2,3)32)18-7-8-19-24-20(14-23(31)27(18,19)5)26(4)11-10-17(28)12-16(26)13-21(24)29/h15-24,28-32H,6-14H2,1-5H3/t15-,16+,17-,18-,19+,20+,21-,22+,23+,24?,26?,27?/m1/s1
SMILESC[C@H](CC[C@H](O)C(C)(C)O)[C@H]1CC[C@H]2C3[C@H](O)C[C@@H]4C[C@H](O)CCC4(C)[C@H]3C[C@H](O)C12C
MNX internals
InChI (mnx)InChI=1/C27H48O5/c1-15(6-9-22(30)25(2,3)32)18-7-8-19-24-20(14-23(31)27(18,19)5)26(4)11-10-17(28)12-16(26)13-21(24)29/h15-24,28-32H,6-14H2,1-5H3/t15-,16+,17-,18-,19+,20+,21-,22+,23+,24?,26?,27?/m1/s1 Image of MNXM1583574
SMILES (mnx)[CH3:1][C@H:15]([CH2:6][CH2:9][C@@H:22]([C:25]([CH3:2])([CH3:3])[OH:32])[OH:30])[C@H:18]1[CH2:7][CH2:8][C@H:19]2[CH:24]3[C@H:20]([CH2:14][C@H:23]([OH:31])[C:27]12[CH3:5])[C:26]1([CH3:4])[CH2:11][CH2:10][C@@H:17]([OH:28])[CH2:12][C@H:16]1[CH2:13][C@H:21]3[OH:29]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

vmhM:xolteolh25oh
vmhM:xolteolh25oh
vmhmetabolite:xolteolh25oh
vmhmetabolite:xolteolh25oh
NHPWQASMMFUHIZ-KHGJHHBHSA-N 		5beta-cholestane-3alpha,7alpha,12alpha,24S,25-pentol
3alpha,7alpha,12alpha,24S,25-Pentahydroxy-5beta-cholestane
5-beta-Cholestane-3 alpha,7 alpha,12 alpha,24 beta,25-pentol
5-beta-Cholestane-3alpha,7alpha,12alpha,24beta,25-pentol
5beta-Cholestane-3alpha,7alpha,12alpha,24S,25-pentol
Cell signaling agent
Cellular membrane
Cholestane-3,7,12,24,25-pentol
Cytoplasma
Digestion
Extracellular region
Fauna
Lipid metabolic process
Liver tissue
Membrane integrity agent
Membrane stability agent
Signal transduction
Signaling agent
Signalling molecule
Surface-active agent

vmhM:CE1273
vmhM:CE1273
vmhM:M_xolteolh25oh 		secondary/obsolete/fantasy identifier