CHEBI:36482 - hopane

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ChEBI Name hopane
ChEBI ID CHEBI:36482
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C30H52
Net Charge 0
Average Mass 412.73388
Monoisotopic Mass 412.407
InChI InChI=1S/C30H52/c1-20(2)21-12-17-27(5)22(21)13-18-29(7)24(27)10-11-25-28(6)16-9-15-26(3,4)23(28)14-19-30(25,29)8/h20-25H,9-19H2,1-8H3/t21-,22+,23+,24-,25-,27+,28+,29-,30-/m1/s1
InChIKey ZRLNBWWGLOPJIC-PYQRSULMSA-N
SMILES [H][C@@]12CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CCCC(C)(C)[C@]5([H])CC[C@@]34C)[C@@]1(C)CC[C@@H]2C(C)C
ChEBI Ontology
Outgoing hopane (CHEBI:36482) is a terpenoid fundamental parent (CHEBI:35662)
hopane (CHEBI:36482) is a triterpene (CHEBI:35191)
Incoming hop-17(21)-ene (CHEBI:132466) has parent hydride hopane (CHEBI:36482)
hop-21(22)-ene (CHEBI:132464) has parent hydride hopane (CHEBI:36482)
hop-22(29)-ene (CHEBI:4648) has parent hydride hopane (CHEBI:36482)
hopanoid (CHEBI:51963) has parent hydride hopane (CHEBI:36482)
IUPAC Name
hopane
Synonym Source
A'-neogammacerane ChemIDplus
Registry Numbers Types Sources
2217001 Beilstein Registry Number Beilstein
471-62-5 CAS Registry Number ChemIDplus
Last Modified
08 November 2016