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24-methylenecycloartanol

PropertiesImage
MNX_IDMNXM1108276 Image of MNXM1108276
referencechebi:1307
formulaC31H52O
global charge0
mol weight440.756
InChIKeyBDHQMRXFDYJGII-UEBIAWITSA-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/h20,22-26,32H,3,9-19H2,1-2,4-8H3/t22-,23-,24+,25+,26+,28-,29+,30-,31+/m1/s1
SMILESC=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)C(C)C
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/h20,22-26,32H,3,9-19H2,1-2,4-8H3/t22-,23-,24+,25+,26+,28-,29+,30-,31+/m1/s1 Image of MNXM1108276
SMILES (mnx)[CH3:1][CH:20]([CH3:2])[C:21](=[CH2:3])[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)15
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:1307
chebi:1307
BDHQMRXFDYJGII-UEBIAWITSA-N 		24-methylenecycloartanol
(3beta,9beta)-24-methylene-9,19-cyclolanostan-3-ol
24(28)-methylenecycloartanol
24-methylene cycloartanol
24-methylene-9beta,19-cyclo-lanostan-3beta-ol
24-methylene-9beta,19-cyclolanostan-3beta-ol
24-methylene-cycloartanol
24-methylenecycloartan-3beta-ol
hmdb:HMDB0303481
BDHQMRXFDYJGII-UEBIAWITSA-N 		24-Methylenecycloartan-3-ol
(1S,3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.0^{1,3}.0^{3,8}.0^{12,16}]octadecan-6-ol
(3b,9b)-24-Methylene-9,19-cyclolanostan-3-ol
(3beta)-24-Methylene-9,19-cyclolanostan-3-ol
(3beta,9beta)-24-Methylene-9,19-cyclolanostan-3-ol
(3beta,9beta)-24-methylene-9,19-cyclolanostan-3-ol
24(28)-Methylenecycloartanol
24-Methylencycloartan-3beta-ol
24-Methylene cycloartanol
24-Methylene-9,19-cyclolanostan-3beta-ol
24-Methylene-9b,19-cyclo-lanostan-3b-ol
24-Methylene-9beta,19-cyclo-lanostan-3beta-ol
24-Methylene-cycloartanol
24-Methylenecycloartan-3b-ol
24-Methylenecycloartan-3beta-ol
24-Methylenecycloartanol
24-Methylenecycloartenol
24-Methylidenecycloartanol
3beta-Hydroxy-24-methylenecycloartane
4a,4b,14a-Trimethyl-9b,19-cyclo-5a-ergost-24(24(1))-en-3b-ol
4alpha,4beta,14alpha-Trimethyl-9beta,19-cyclo-5alpha-ergost-24(24(1))-en-3beta-ol
4alpha,4beta,14alpha-trimethyl-9beta,19-cyclo-5alpha-ergost-24(24(1))-en-3beta-ol
9,19-Cyclo-24-methylenelanostan-3beta-ol

vmhM:24mcartnl
vmhmetabolite:24mcartnl
BDHQMRXFDYJGII-UEBIAWITSA-N 		24-Methylenecycloartanol

seed.compound:cpd05727
seedM:cpd05727
BDHQMRXFDYJGII-UEBIAWITSA-N 		24-Methylenecycloartanol
24(28)-methylenecycloartanol
24-methylenecycloartanol
9,19-Cyclolanostan-3-o1, 24-methylene-, (3beta)-

sabiork.compound:10922
sabiorkM:10922
BDHQMRXFDYJGII-UEBIAWITSA-N 		24-Methylenecycloartanol
9,19-Cyclolanostan-3-o1, 24-methylene-, (3beta)-

kegg.compound:C08830
keggC:C08830
BDHQMRXFDYJGII-UEBIAWITSA-N 		24-Methylidenecycloartanol
24-Methylenecycloartanol
4alpha,4beta,14alpha-Trimethyl-9beta,19-cyclo-5alpha-ergost-24(24(1))-en-3beta-ol
9,19-Cyclolanostan-3-o1, 24-methylene-, (3beta)-

lipidmaps:LMST01100001
lipidmapsM:LMST01100001
BDHQMRXFDYJGII-UEBIAWITSA-N 		24-methylene-cycloartanol
24-methylene-9beta,19-cyclo-lanostan-3beta-ol
O
ST 31:2

metacyc.compound:CPD-696
metacycM:CPD-696
BDHQMRXFDYJGII-UEBIAWITSA-N 		24-methylenecycloartanol
24(28)-methylenecycloartanol

keggC:M_C08830
seedM:M_cpd05727
vmhM:M_24mcartnl 		secondary/obsolete/fantasy identifier