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Contignasterol

PropertiesImageOccurences in reactions
MNX_IDMNXM47600Image of MNXM47600
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC29H48O7
charge0
mass508.34
referencekeggC:C19902
InChIKeyIRHVLQMEQPABHG-GHFTVTFTSA-N
InChIInChI=1S/C29H48O7/c1-13(2)15-10-20(36-21(32)11-15)14(3)17-12-19(31)23-22-16(6-8-29(17,23)5)28(4)9-7-18(30)25(33)24(28)27(35)26(22)34/h13-18,20-27,30,32-35H,6-12H2,1-5H3/t14-,15+,16-,17+,18+,20+,21?,22+,23+,24+,25-,26+,27+,28+,29+/m0/s1
SMILESCC(C)[C@H]1CC(O)O[C@@H]([C@@H](C)[C@H]2CC(=O)[C@@H]3[C@H]4[C@H](CC[C@]23C)[C@@]2(C)CC[C@@H](O)[C@H](O)[C@@H]2[C@@H](O)[C@@H]4O)C1
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
seed.compound:cpd21141
seedM:cpd21141
kegg.compound:C19902
keggC:C19902
Contignasterol
keggC:M_C19902
seedM:M_cpd21141
secondary/obsolete/fantasy identifier