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obtusifoliol

MNXM2144 is deprecated and here replaced by MNXM732526
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM732526 Image of MNXM732526
referencechebi:17791
formulaC30H50O
global charge0
mol weight426.729
InChIKeyMMNYKQIDRZNIKT-VSADUBDNSA-N
InChIInChI=1S/C30H50O/c1-19(2)20(3)9-10-21(4)23-13-17-30(8)26-12-11-24-22(5)27(31)15-16-28(24,6)25(26)14-18-29(23,30)7/h19,21-24,27,31H,3,9-18H2,1-2,4-8H3/t21-,22+,23-,24+,27+,28+,29-,30+/m1/s1
SMILESC=C(CC[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)[C@@H](C)[C@@H]1CC3)C(C)C
MNX internals
InChI (mnx)InChI=1/C30H50O/c1-19(2)20(3)9-10-21(4)23-13-17-30(8)26-12-11-24-22(5)27(31)15-16-28(24,6)25(26)14-18-29(23,30)7/h19,21-24,27,31H,3,9-18H2,1-2,4-8H3/t21-,22+,23-,24+,27+,28+,29-,30+/m1/s1 Image of MNXM732526
SMILES (mnx)[CH3:1][CH:19]([CH3:2])[C:20](=[CH2:3])[CH2:9][CH2:10][C@@H:21]([CH3:4])[C@H:23]1[CH2:13][CH2:17][C@@:30]2([CH3:8])[C:26]3=[C:25]([CH2:14][CH2:18][C@:29]12[CH3:7])[C@@:28]1([CH3:6])[CH2:16][CH2:15][C@H:27]([OH:31])[C@@H:22]([CH3:5])[C@@H:24]1[CH2:11][CH2:12]3
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)13
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:17791
chebi:17791
MMNYKQIDRZNIKT-VSADUBDNSA-N 		obtusifoliol
(+)-obtusifoliol
(3beta,4alpha,5alpha)-4,14-dimethylergosta-8,24(28)-dien-3-ol
4alpha,14-dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol
4alpha,14alpha-Dimethyl-24-methylene-5alpha-cholesta-8-en-3beta-ol
4alpha,14alpha-Dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol
4alpha,14alpha-dimethyl-24-methylene-cholest-8-en-3beta-ol
4alpha,14alpha-dimethyl-Delta(8,24(28))-ergostadien-3beta-ol

vmhM:obtsfl
vmhmetabolite:obtsfl
MMNYKQIDRZNIKT-VSADUBDNSA-N 		Obtusifoliol
hmdb:HMDB0001242
MMNYKQIDRZNIKT-VSADUBDNSA-N 		Obtusifoliol
(+)-Obtusifoliol
(2S,5S,6S,7S,11R,14R,15R)-2,6,11,15-tetramethyl-14-[(2R)-6-methyl-5-methylideneheptan-2-yl]tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(10)-en-5-ol
(3beta,4alpha,5alpha)-4,14-Dimethylergosta-8,24(28)-dien-3-ol
4a,14a-Dimethyl-24-methylene-5a-cholesta-8-en-3b-ol
4a,14a-Dimethyl-5a-ergosta-8,24(28)-dien-3b-ol
4alpha,14alpha-Dimethyl-24-methylene-5alpha-cholesta-8-en-3beta-ol
4alpha,14alpha-Dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol
4alpha,14alpha-Dimethyl-delta8,24(28)-ergostadien-3beta-ol

kegg.compound:C01943
keggC:C01943
MMNYKQIDRZNIKT-VSADUBDNSA-N 		Obtusifoliol
4alpha,14alpha-Dimethyl-24-methylene-5alpha-cholesta-8-en-3beta-ol
4alpha,14alpha-Dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol

seed.compound:cpd01334
seedM:cpd01334
MMNYKQIDRZNIKT-VSADUBDNSA-N 		Obtusifoliol
4alpha,14alpha-Dimethyl-24-methylene-5alpha-cholesta-8-en-3beta-ol
4alpha,14alpha-Dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol
4alpha,14alpha-dimethyl-24-methylene-5alpha-cholesta-8-en-3beta-ol
4alpha,14alpha-dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol
obtusifoliol

lipidmaps:LMST01030101
lipidmapsM:LMST01030101
MMNYKQIDRZNIKT-VSADUBDNSA-N 		Obtusifoliol
4alpha,14alpha-dimethyl-24-methylene-cholest-8-en-3beta-ol
O
ST 30:2

SLM:000000465
slm:000000465
MMNYKQIDRZNIKT-YLANKJTKSA-N 		obtusifoliol

metacyc.compound:OBTUSIFOLIOL
metacycM:OBTUSIFOLIOL
MMNYKQIDRZNIKT-VSADUBDNSA-N 		obtusifoliol
4alpha,14alpha-dimethyl-24-methylene-5alpha-cholesta-8-en-3beta-ol
4alpha,14alpha-dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol

hmdb:HMDB0006843
hmdb:HMDB01242
hmdb:HMDB06843
chebi:14678
chebi:25624
chebi:7717
keggC:M_C01943
seedM:M_cpd01334
vmhM:M_obtsfl 		secondary/obsolete/fantasy identifier