CHEBI:81371 - Simiarenol

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ChEBI Name Simiarenol
ChEBI ID CHEBI:81371
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C30H50O
Net Charge 0
Average Mass 426.71740
Monoisotopic Mass 426.38617
InChI InChI=1S/C30H50O/c1-19(2)20-9-12-23-27(20,5)15-17-30(8)24-13-10-21-22(11-14-25(31)26(21,3)4)28(24,6)16-18-29(23,30)7/h10,19-20,22-25,31H,9,11-18H2,1-8H3/t20-,22-,23-,24+,25+,27-,28+,29+,30-/m1/s1
InChIKey XVXPXUMUGATHPD-JMJRLLIOSA-N
SMILES CC(C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@]1(C)[C@H]3CC=C4[C@@H](CC[C@H](O)C4(C)C)[C@]3(C)CC[C@@]21C
ChEBI Ontology
Outgoing Simiarenol (CHEBI:81371) is a triterpenoid (CHEBI:36615)
Manual Xref Database
C17901 KEGG COMPOUND
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Registry Number Type Source
1615-94-7 CAS Registry Number KEGG COMPOUND