Echiumine

Catalog Number	ACM633169
CAS Number	633-16-9
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-KJSUXLSRSA-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 product name of the compound with CAS number 633-16-9?

The product name is ECHIUMINE.

What are some synonyms for ECHIUMINE?

Some synonyms for ECHIUMINE are 2-Butenoic acid, 2-methyl-, (1R,7aR)-7-[[(2S,3R)-2,3-dihydroxy-2-(1-methylethyl)-1-oxobutoxy]methyl]-2,3,5,7a-tetrahydro-1H-pyrrolizin-1-yl ester, (2Z)-

What is the molecular formula of ECHIUMINE?

The molecular formula of ECHIUMINE is C20H31NO6.

What is the molecular weight of ECHIUMINE?

The molecular weight of ECHIUMINE is 381.46.

What is the CAS number of ECHIUMINE?

The CAS number of ECHIUMINE is 633-16-9.

What is the systematic name of ECHIUMINE?

The systematic name of ECHIUMINE is 2-Butenoic acid, 2-methyl-, (1R,7aR)-7-[[(2S,3R)-2,3-dihydroxy-2-(1-methylethyl)-1-oxobutoxy]methyl]-2,3,5,7a-tetrahydro-1H-pyrrolizin-1-yl ester, (2Z)-

What are the functional groups present in ECHIUMINE?

ECHIUMINE contains methyl, hydroxy, and ester functional groups.

What is the stereochemistry of ECHIUMINE?

ECHIUMINE has stereochemistry with (1R,7aR) and (2S,3R) configurations.

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