Myoscorpine

Catalog Number	ACM82535760
CAS Number	82535-76-0
Synonyms	(2S,3R)-2,3-Dihydroxy-2-isopropylbutanoic acid [[(7R)-5,6,7,7aα-tetrahydro-7β-[(E)-2-methyl-2-butenoyloxy]-3H-pyrrolizin]-1-ylmethyl] ester
Molecular Weight	381.5
InChI	InChI=1S/C20H31NO6/c1-6-13(4)18(23)27-16-8-10-21-9-7-15(17(16)21)11-26-19(24)20(25,12(2)3)14(5)22/h6-7,12,14,16-17,22,25H,8-11H2,1-5H3/b13-6+/t14-,16-,17-,20+/m1/s1
InChI Key	MVWPTZQHBOWRTF-MVEITQORSA-N
Purity	95%+
Complexity	640
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Exact Mass	381.21513771
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
Isomeric SMILES	C/C=C(\C)/C(=O)O[C@@H]1CCN2[C@@H]1C(=CC2)COC(=O)[C@@]([C@@H](C)O)(C(C)C)O
Monoisotopic Mass	381.21513771
PhysicalState	Powder
Rotatable Bond Count	9
Topological Polar Surface Area	96.3 Ų

Custom Q&A

What is the chemical name of Myoscorpine?

(2S,3R)-2,3-Dihydroxy-2-isopropylbutanoic acid [[(7R)-5,6,7,7aα-tetrahydro-7β-[(E)-2-methyl-2-butenoyloxy]-3H-pyrrolizin]-1-ylmethyl] ester

What is the synonym for Myoscorpine?

Myoscorpine

What is the CAS number of Myoscorpine?

82535-76-0

What is the molecular formula of Myoscorpine?

C20H31NO6

What is the molecular weight of Myoscorpine?

381.46

What is the boiling point of Myoscorpine?

505.0±50.0 °C (Predicted)

What is the density of Myoscorpine?

1.20±0.1 g/cm3 (Predicted)

What is the pKa value of Myoscorpine?

12.59±0.29 (Predicted)

What is the predicted formula for the pKa of Myoscorpine?

12.59±0.29

What is the predicted molecular weight of Myoscorpine?

381.46

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