Scholaricine

Catalog Number	ACM99694903
CAS Number	99694-90-3
Synonyms	(19S)-Scholaricine
Molecular Weight	356.4
InChI	InChI=1S/C20H24N2O4/c1-10(23)12-9-22-7-6-20-13-4-3-5-14(24)17(13)21-18(20)16(19(25)26-2)11(12)8-15(20)22/h3-5,10-12,15,21,23-24H,6-9H2,1-2H3/t10-,11-,12-,15-,20+/m0/s1
InChI Key	GNCUCBQZLQLSOF-IGWMUPSQSA-N
Purity	95%+
Complexity	664
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	5
Exact Mass	356.17360725
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
Isomeric SMILES	C[C@@H]([C@@H]1CN2CC[C@@]34[C@@H]2C[C@@H]1C(=C3NC5=C4C=CC=C5O)C(=O)OC)O
Monoisotopic Mass	356.17360725
PhysicalState	Powder
Rotatable Bond Count	3
Topological Polar Surface Area	82 Ų

Custom Q&A

What is the product name of the alkaloid with CAS number 99694-90-3?

The product name is Scholaricine.

What are some synonyms for the chemical Scholaricine?

Some synonyms for Scholaricine are (19S)-scholaricine and Curan-17-oic acid, 2,16-didehydro-12,19-dihydroxy-, methyl ester, (19S)-.

What is the molecular formula of Scholaricine?

The molecular formula of Scholaricine is C20H24N2O4.

What is the molecular weight of Scholaricine?

The molecular weight of Scholaricine is 356.42.

What is the predicted boiling point of Scholaricine?

The predicted boiling point of Scholaricine is 519.5±50.0 °C.

What is the predicted density of Scholaricine?

The predicted density of Scholaricine is 1.42±0.1 g/cm3.

What is the predicted pKa value of Scholaricine?

The predicted pKa value of Scholaricine is 10.33±0.60.

What is the role of Scholaricine according to ChEBI?

According to ChEBI, Scholaricine is an alkaloid with a role as a metabolite.

Is Scholaricine a naturally occurring compound or a synthetic chemical?

Scholaricine is a naturally occurring alkaloid compound.

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