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AG0054FC

Name: Lovastatin Diol Lactone
Brand: Angene Chemical
SKU: AG0054FC

79952-42-4 | Lovastatin Diol Lactone

Chemical structure of Lovastatin Diol Lactone, CAS 79952-42-4

AG0054FC

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CAS Number	79952-42-4
Catalog Number	AG0054FC(AGN-PC-0UFT9C)
Chemical Name	Lovastatin Diol Lactone
EC Number	616-759-1
IUPAC Name	(4R,6R)-6-[2-[(1S,2S,6R,8S,8aR)-8-hydroxy-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-4-hydroxyoxan-2-one
InChI	InChI=1S/C19H28O4/c1-11-7-13-4-3-12(2)16(19(13)17(21)8-11)6-5-15-9-14(20)10-18(22)23-15/h3-4,7,11-12,14-17,19-21H,5-6,8-10H2,1-2H3/t11-,12-,14+,15+,16-,17-,19-/m0/s1
InChI Key	ZDFOBOYQVYMVCW-IRUSZSJRSA-N
MDL Number	MFCD09832923
Molecular Formula	C19H28O4
Molecular Weight	320.4232
SMILES	C1(=O)O[C@H](CC[C@@H]2[C@]3([H])C(=C[C@H](C)C[C@@H]3O)C=C[C@@H]2C)C[C@@H](O)C1
UNII	P5IQ0SI56N
Synonyms	monacolin J, Monacolin J, UNII-P5IQ0SI56N, Antibiotic MB 530A, P5IQ0SI56N, 79952-42-4, monakolin j, monacolin J lactone, SCHEMBL1820283, CHEBI:79034, ZINC14594736, AKOS022183350, AJ-65000, HY-104051, CS-0027590, (4R)-4alpha-Hydroxy-6beta-[2-[(1S)-2beta,6alpha-dimethyl-8alpha-hydroxy-1,2,6,7,8,8abeta-hexahydronaphthalene-1beta-yl]ethyl]tetrahydro-2H-pyran-2-one, (4R,6R)-4-hydroxy-6-{2-[(1S,2S,6R,8S,8aR)-8-hydroxy-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl}tetrahydro-2H-pyran-2-one, (4R,6R)-6-[2-[(1S,2S,6R,8S,8aR)-1,2,6,7,8,8a-Hexahydro-8-hydroxy-2,6-dimethyl-1-naphthalenyl]ethyl]tetrahydro-4-hydroxy-2H-pyran-2-one, 6(R)-[2-(8(S)-Hydroxy]-2(S),6(R)-dimethyl-1,2,6,7,8,8a(R)-hexahydro-1(S)-naphthyl]ethyl-4(R)-hydroxy-3,4,5,6-tetrahydro-2H-pyran-2-one, Lovastatin Diol Lactone, Lovastatin Lactone Diol, CID9905162, 2H-Pyran-2-one, 6-(2-(1,2,6,7,8,8a-hexahydro-8-hydroxy-2,6-dimethyl-1-naphthalenyl)ethyl)tetrahydro-4-hydroxy-,

Complexity	510
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	7
Defined Bond Stereocenter Count	0
Exact Mass	320.199g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	320.429g/mol
Monoisotopic Mass	320.199g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Related Research Chemicals

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited