cyprinol (CHEBI:50421)

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CHEBI:50421 - cyprinol

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ChEBI ID	CHEBI:50421
ChEBI Name	cyprinol
Stars
Last Modified	11 August 2008
Submitter	Kirill Degtyarenko
Downloads	Molfile

Formula	C27H48O5
Net Charge	0
Average Mass	452.676
Monoisotopic Mass	452.35017
SMILES	[H][C@@]12CC[C@]([H])([C@H](C)CCCC(CO)CO)[C@@]1(C)[C@@H](O)C[C@@]1([H])[C@@]2([H])[C@H](O)CC2C[C@H](O)CC[C@@]21C
InChI	InChI=1S/C27H48O5/c1-16(5-4-6-17(14-28)15-29)20-7-8-21-25-22(13-24(32)27(20,21)3)26(2)10-9-19(30)11-18(26)12-23(25)31/h16-25,28-32H,4-15H2,1-3H3/t16-,18?,19-,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1
InChIKey	JNMALBXXJSWZQY-VKYZUIDCSA-N

ChEBI Ontology

Outgoing Relation(s)
	cyprinol (CHEBI:50421) is a bile alcohol (CHEBI:50420)
Incoming Relation(s)
	5α-cyprinol (CHEBI:50422) is a cyprinol (CHEBI:50421)
	5β-cyprinol (CHEBI:37913) is a cyprinol (CHEBI:50421)

IUPAC Name
cholestane-3α,7α,12α,26,27-pentol