CHEBI:59367 - scalarane

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ChEBI Name scalarane
ChEBI ID CHEBI:59367
Definition A hypothetical sesterterpene skeleton with a structure based on that of a pentamethyl-D-homoandrostane and the basis for the family of scalarane sesterterpenoids.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C25H44
Net Charge 0
Average Mass 344.61690
Monoisotopic Mass 344.34430
InChI InChI=1S/C25H44/c1-17-9-10-20-23(5,18(17)2)15-12-21-24(6)14-8-13-22(3,4)19(24)11-16-25(20,21)7/h17-21H,8-16H2,1-7H3/t17?,18?,19?,20?,21?,23-,24+,25+/m1/s1
InChIKey GVFFAMRIFGYUEO-NWZCTALXSA-N
SMILES CC1CCC2[C@](C)(CCC3[C@@]4(C)CCCC(C)(C)C4CC[C@@]23C)C1C
ChEBI Ontology
Outgoing scalarane (CHEBI:59367) is a sesterterpene (CHEBI:35192)
IUPAC Name
4,4,8,17,17a-pentamethyl-17a-homoandrostane
Last Modified
29 October 2012