Anidulafungin Side Chain Acid

CAT: 1299-RM-A140401-01Size: 10 mgDry Ice: NoHazardous: No

1 / 1

CAT#:1299-RM-A140401-01Size:10 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

158938-08-0

Synonyms

4''- (pentyloxy) -[1,1':4',1''-terphenyl]-4-carboxylic acid

Molecular Formula

C24H24O3

Molecular Weight

360.45

Target Alternative Name

Anidulafungin

Product Name Synonym

4''- (pentyloxy) -[1,1':4',1''-terphenyl]-4-carboxylic acid

Chemical Information

158938-08-0 4-N-Pentoxyterphenyl-carbonic acid

CAS Number	158938-08-0
PubChem CID	9798987
IUPAC Name	4-[4-(4-pentoxyphenyl)phenyl]benzoic acid
Molecular Formula	C24H24O3
Molecular Weight	360.4
XLogP	7.4
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	8
Heavy Atom Count	27
Formal Charge	0
Complexity	425

SMILES

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C24H24O3/c1-2-3-4-17-27-23-15-13-21(14-16-23)19-7-5-18(6-8-19)20-9-11-22(12-10-20)24(25)26/h5-16H,2-4,17H2,1H3,(H,25,26)

InChIKey

APIUMVXKBCYBSC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 158938-08-0

CID: 9798987

Formula: C24H24O3

MW: 360.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	360.4
XLogP3	7.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	8
Exact Mass	360.17254462
Monoisotopic Mass	360.17254462
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	425
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-A140402-01	Anidulafungin Side Chain Methyl Ester
RM-P812530-01	Paclitaxel Side Chain Acid
RM-M030603-01	Micafungin Side Chain Acid
RM-M030604-01	Micafungin Side Chain Acid Benzotriazole Ester
RM-E201629-01	Ertapenem Side Chain Enantiomer
RM-A140400-01	Anidulafungin
RM-M030605-01	Micafungin Side Chain Methyl Ester
RM-A140408-01	Anidulafungin Impurity 8
RM-A140407-01	Anidulafungin Impurity 7
RM-A140406-01	Anidulafungin Impurity 6

Catalog	Name
AR-O01597-01	Paclitaxel Side Chain Acid
22192-04	Delabeling agent solution for side chain (Components of DL-Amino Acid Labeling Kit)
285549-01	Doripenem side-chain
441585-01	Anidulafungin Open-chain Degradant discontinued
447667-01	Doripenem side-chain discontinued
AR-L08110-01	Liraglutide α-Glu (side chain)
GTR19153329-01	Taxol Side Chain β-lactam
GTR19153181-01	Taxol Side Chain Diol
AR-F10206-01	Florfenicol-d3 (on side chain)
AR-L01888-01	Loratadine Side Chain Impurity