Oudemicin

CAT: 1596-AR-O01574-06Size: 250 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-O01574-06Size:250 Units

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CAS Number

73341-71-6

Synonyms

(2E,3S,4S,5E) -methyl 4-methoxy-2- (methoxymethylene) -3-methyl-6-phenylhex-5-enoate; Oudemansin; (3S,4S,5E) -4-Methoxy-2-[ (E) -methoxymethylene]-3-methyl-6-phenyl-5-hexenoic acid methyl ester; Oudemansin A; Oudemicin

Molecular Formula

C17H22O4

Molecular Weight

290.36

API Name

Oudemicin

Chemical Information

Oudemansin

Oudemansin A is a member of styrenes.

CAS Number	73341-71-6
PubChem CID	6438712
IUPAC Name	methyl (E,2E,3S,4S)-4-methoxy-2-(methoxymethylidene)-3-methyl-6-phenylhex-5-enoate
Molecular Formula	C17H22O4
Molecular Weight	290.4
XLogP	3
Topological Polar Surface Area	44.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Heavy Atom Count	21
Formal Charge	0
Complexity	367

SMILES

C[C@H]([C@H](/C=C/C1=CC=CC=C1)OC)/C(=C\OC)/C(=O)OC

InChI

InChI=1S/C17H22O4/c1-13(15(12-19-2)17(18)21-4)16(20-3)11-10-14-8-6-5-7-9-14/h5-13,16H,1-4H3/b11-10+,15-12+/t13-,16-/m0/s1

InChIKey

COBDENJOXQSLKO-NKAAJRRHSA-N

Chemical Structure

2D Structure

CAS: 73341-71-6

CID: 6438712

Formula: C17H22O4

MW: 290.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	290.4
XLogP3	3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Exact Mass	290.15180918
Monoisotopic Mass	290.15180918
Topological Polar Surface Area	44.8 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	367
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	2
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Oudemicin

Chemical Information

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