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24-hydroxy-beta-amyrin

MNXM4308 is deprecated and here replaced by MNXM1371719
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1371719 Image of MNXM1371719
referencechebi:62459
formulaC30H50O2
global charge0
mol weight442.728
InChIKeyNTWLPZMPTFQYQI-FLZFTVBESA-N
InChIInChI=1S/C30H50O2/c1-25(2)14-15-26(3)16-17-29(6)20(21(26)18-25)8-9-23-27(4)12-11-24(32)28(5,19-31)22(27)10-13-30(23,29)7/h8,21-24,31-32H,9-19H2,1-7H3/t21-,22+,23+,24-,26+,27-,28+,29+,30+/m0/s1
SMILESCC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1
MNX internals
InChI (mnx)InChI=1/C30H50O2/c1-25(2)14-15-26(3)16-17-29(6)20(21(26)18-25)8-9-23-27(4)12-11-24(32)28(5,19-31)22(27)10-13-30(23,29)7/h8,21-24,31-32H,9-19H2,1-7H3/t21-,22+,23+,24-,26+,27-,28+,29+,30+/m0/s1 Image of MNXM1371719
SMILES (mnx)[CH3:1][C:25]1([CH3:2])[CH2:14][CH2:15][C@:26]2([CH3:3])[CH2:16][CH2:17][C@:29]3([CH3:6])[C:20](=[CH:8][CH2:9][C@@H:23]4[C@@:27]5([CH3:4])[CH2:12][CH2:11][C@H:24]([OH:32])[C@:28]([CH3:5])([CH2:19][OH:31])[C@@H:22]5[CH2:10][CH2:13][C@:30]43[CH3:7])[C@@H:21]2[CH2:18]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)7
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:62459
chebi:62459
NTWLPZMPTFQYQI-FLZFTVBESA-N 		24-hydroxy-beta-amyrin
(3beta)-olean-12-ene-3,24-diol
3beta,24-dihydroxyolean-12-ene
olean-12-ene-3beta,24-diol

seed.compound:cpd20979
seedM:cpd20979
NTWLPZMPTFQYQI-FLZFTVBESA-N 		24-Hydroxy-beta-amyrin
24-hydroxy-beta-amyrin
Olean-12-ene-3beta,24-diol
olean-12-ene-3beta,24-diol

kegg.compound:C19732
keggC:C19732
NTWLPZMPTFQYQI-FLZFTVBESA-N 		24-Hydroxy-beta-amyrin
Olean-12-ene-3beta,24-diol

keggC:M_C19732
seedM:M_cpd20979 		secondary/obsolete/fantasy identifier