Jacoline

Catalog Number	ACM480762
CAS Number	480-76-2
Synonyms	(20R)-12,15,20-Trihydroxy-(15αH)-15,20-dihydro-senecionane-11,16-dione
Molecular Weight	369.4
InChI	InChI=1S/C18H27NO7/c1-10-8-18(24,11(2)20)16(22)26-13-5-7-19-6-4-12(14(13)19)9-25-15(21)17(10,3)23/h4,10-11,13-14,20,23-24H,5-9H2,1-3H3
InChI Key	FMWJEBGSMAOQNN-UHFFFAOYSA-N
Melting Point	221 °C
Purity	95%+
Complexity	635
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Exact Mass	369.1787522
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	3
Monoisotopic Mass	369.1787522
PhysicalState	Powder
Rotatable Bond Count	1
Topological Polar Surface Area	117 Ų

Custom Q&A

What are some synonyms for the compound Jacoline?

Jacolin, [1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione, 3,4,5,6,9,11,13,14,14a,14b-decahydro-3,6-dihydroxy-3-[(1R)-1-hydroxyethyl]-5,6-dimethyl-, (3R,5R,6S,14aR,14bR)-, (20R)-12,15,20-trihydroxy-(15αH)-15,20-dihydro-senecionane-11,16-dione

What is the CAS number for Jacoline?

480-76-2

What is the molecular formula of Jacoline?

C18H27NO7

What is the molecular weight of Jacoline?

369.41

What is the melting point of Jacoline?

221°C

What is the boiling point of Jacoline?

583.5±50.0 °C (Predicted)

What is the density of Jacoline?

1.36±0.1 g/cm3 (Predicted)

What is the pKa of Jacoline?

12.40±0.60 (Predicted)

Where is Jacoline found naturally?

Jacoline is found in the nectar of tansy ragwort (Senecio jacobaea).

What are some of the potential health risks associated with Jacoline?

It is potentially carcinogenic, mutagenic, teratogenic, and hepatotoxic.

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