CHEBI:189409 - 21-beta-H-hopane-3-beta,22-diol

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ChEBI Name 21-beta-H-hopane-3-beta,22-diol
ChEBI ID CHEBI:189409
Definition A triterpene.
Stars This entity has been manually annotated by a third party.
Submitter Tereza Calounova
Supplier Information
Download Molfile XML SDF
Formula C30H52O2
Net Charge 0
Average Mass 444.744
Monoisotopic Mass 444.39673
InChI InChI=1S/C30H52O2/c1-25(2)21-13-18-30(8)23(28(21,6)16-14-24(25)31)10-9-22-27(5)15-11-19(26(3,4)32)20(27)12-17-29(22,30)7/h19-24,31-32H,9-18H2,1-8H3/t19-,20-,21-,22+,23+,24-,27-,28-,29+,30+/m0/s1
InChIKey FNUXMEOWJVTJJE-DTXRQUTOSA-N
SMILES C1[C@]2([C@](C([C@H](C1)O)(C)C)(CC[C@@]3([C@@]2(CC[C@]4([C@]3(CC[C@@]5([C@@]4(CC[C@@H]5C(C)(C)O)C)[H])C)[H])[H])C)[H])C
ChEBI Ontology
Outgoing 21-beta-H-hopane-3-beta,22-diol (CHEBI:189409) is a pentacyclic triterpenoid (CHEBI:25872)
Synonym Source
21βH-hopane-3β,22-diol UniProt
Citation Waiting for Citations Type Source
30977375 PubMed citation SUBMITTER
Last Modified
06 August 2024