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(24R)-24-methylcycloart-25-en-3beta-ol

PropertiesImage
MNX_IDMNXM4164 Image of MNXM4164
referencechebi:15576
formulaC31H52O
global charge0
mol weight440.756
InChIKeyIXHACUTUTOCSJE-CUIMAKJMSA-N
InChIInChI=1S/C31H52O/c1-20(2)21(3)9-10-22(4)23-13-15-29(8)25-12-11-24-27(5,6)26(32)14-16-30(24)19-31(25,30)18-17-28(23,29)7/h21-26,32H,1,9-19H2,2-8H3/t21-,22-,23-,24+,25+,26+,28-,29+,30-,31+/m1/s1
SMILESC=C(C)[C@H](C)CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O)CC[C@@]45C[C@@]35CC[C@]12C
MNX internals
InChI (mnx)InChI=1/C31H52O/c1-20(2)21(3)9-10-22(4)23-13-15-29(8)25-12-11-24-27(5,6)26(32)14-16-30(24)19-31(25,30)18-17-28(23,29)7/h21-26,32H,1,9-19H2,2-8H3/t21-,22-,23-,24+,25+,26+,28-,29+,30-,31+/m1/s1 Image of MNXM4164
SMILES (mnx)[CH2:1]=[C:20]([CH3:2])[C@H:21]([CH3:3])[CH2:9][CH2:10][C@@H:22]([CH3:4])[C@H:23]1[CH2:13][CH2:15][C@@:29]2([CH3:8])[C@@H:25]3[CH2:12][CH2:11][C@H:24]4[C:27]([CH3:5])([CH3:6])[C@@H:26]([OH:32])[CH2:14][CH2:16][C@@:30]45[CH2:19][C@@:31]35[CH2:18][CH2:17][C@:28]12[CH3:7]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:15576
chebi:15576
IXHACUTUTOCSJE-CUIMAKJMSA-N 		(24R)-24-methylcycloart-25-en-3beta-ol
(24R)-24-Methylcycloarta-8,25-dien-3-beta-ol
(24R)-24-methyl-9beta,19-cyclolanost-25-en-3beta-ol
(3beta,9beta,24R)-24-methyl-9,19-cyclolanost-25-en-3-ol

kegg.compound:C11513
keggC:C11513
IXHACUTUTOCSJE-CUIMAKJMSA-N 		(24R)-24-Methylcycloart-25-en-3-beta-ol

seed.compound:cpd08352
seedM:cpd08352
IXHACUTUTOCSJE-CUIMAKJMSA-N 		(24R)-24-Methylcycloarta-25-en-3-beta-ol
(24R)-24-methylcycloarta-25-en-3-beta-ol

SLM:000000472
slm:000000472
IXHACUTUTOCSJE-CUIMAKJMSA-N 		(24R)-24-methylcycloart-25-en-3beta-ol

lipidmaps:LMST01100010
lipidmapsM:LMST01100010
IXHACUTUTOCSJE-CUIMAKJMSA-N 		(24R)-24-methylcycloart-25-en-3beta-ol
(24R)-24-Methylcycloarta-8,25-dien-3-beta-ol
(24R)-24-methyl-9beta,19-cyclolanost-25-en-3beta-ol
(24R)-24-methylcycloart-25-en-3beta-ol
(3beta,9beta,24R)-24-methyl-9,19-cyclolanost-25-en-3-ol
O
ST 31:2

metacyc.compound:24R-24-METHYLCYCLOARTA-825-DIEN-3-BET
metacycM:24R-24-METHYLCYCLOARTA-825-DIEN-3-BET
IXHACUTUTOCSJE-CUIMAKJMSA-N 		(24R)-24-methylcycloarta-25-en-3-beta-ol

chebi:10852
chebi:176
keggC:M_C11513
seedM:M_cpd08352 		secondary/obsolete/fantasy identifier