**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

tirucalla-7,24-dien-3beta-ol

Properties Image MNX_ID MNXM5954 reference chebi:63468 formula C30H50O global charge 0 mol weight 426.729 InChIKey DICCPNLDOZNSML-CEEMYSEHSA-N InChI InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,12,21-23,25-26,31H,9,11,13-19H2,1-8H3/t21-,22-,23-,25-,26-,28+,29-,30+/m0/s1 SMILES CC(C)=CCC[C@H](C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]12C MNX internals InChI (mnx) InChI=1/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,12,21-23,25-26,31H,9,11,13-19H2,1-8H3/t21-,22-,23-,25-,26-,28+,29-,30+/m0/s1 SMILES (mnx) [C@:1]12([CH3:13])[C@@:2]([CH3:14])([CH2:7][CH2:8][C@@H:5]3[C@:3]4([CH3:15])[C@@H:6]([CH2:10][CH:9]=[C:4]13)[C:11]([CH3:19])([CH3:20])[CH:16]([CH3:18])[CH2:17][CH2:12]4)[C@H:23]([C@@H:24]([CH2:26][CH2:25]/[CH:28]=[C:29](\[CH3:30])[OH:31])[CH3:27])[CH2:22][CH2:21]2

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 1

Similar chemical compounds in external resources

Identifier	Description
CHEBI:63468 chebi:63468 DICCPNLDOZNSML-CEEMYSEHSA-N	tirucalla-7,24-dien-3beta-ol (13alpha,14beta,17alpha,20S)-lanosta-7,24-dien-3beta-ol (3beta,13alpha,14beta,17alpha,20S)-lanosta-7,24-dien-3-ol 5alpha-tirucalla-7,24-dien-3beta-ol Delta(7)-tirucallol tirucalladienol
seed.compound:cpd21428 seedM:cpd21428 kegg.compound:C20195 keggC:C20195 DICCPNLDOZNSML-CEEMYSEHSA-N	Tirucalla-7,24-dien-3beta-ol
metacyc.compound:CPD-13276 metacycM:CPD-13276 seed.compound:cpd23808 seedM:cpd23808 DICCPNLDOZNSML-ZVSNHUJDSA-N	tirucalla-7,24-diene-3beta-ol
keggC:M_C20195 seedM:M_cpd21428 seedM:M_cpd23808	secondary/obsolete/fantasy identifier