Erythromycin C

CAT: 0013-GTR19190204-01Size: 500 µgDry Ice: NoHazardous: No

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Description

Erythromycin C (CAS 1675-02-1) is a macrolide antibiotic used in life science research. It serves as a valuable tool for studying antibiotic mechanisms and bacterial protein synthesis inhibition in both in vitro and in vivo experimental models.

CAS Number

1675-02-1

Field of Research

Infectious Disease & Virology, Pharmacology & Drug Discovery

Smiles

[H][C@@]1 (C[C@@] (C) (O) [C@@H] (O) [C@H] (C) O1) O[C@H]1[C@H] (C) [C@@H] (O[C@]2 ([H]) O[C@H] (C) C[C@@H] ([C@H]2O) N (C) C) [C@] (C) (O) C[C@@H] (C) C (=O) [C@H] (C) [C@@H] (O) [C@] (C) (O) [C@@H] (CC) OC (=O) [C@@H]1C

Molecular Formula

C36H65NO13

Molecular Weight

719.9

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Erythromycin C

Erythromycin C is an erythromycin that consists of erythronolide A having 2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyl and 3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranosyl residues attahced at positions 4 and 6 respectively. It is functionally related to an erythronolide A. It is a conjugate base of an erythromycin C(1+).

CAS Number	1675-02-1
PubChem CID	83933
IUPAC Name	(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-4-[(2R,4R,5S,6S)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione
Molecular Formula	C36H65NO13
Molecular Weight	719.9
XLogP	2.2
Topological Polar Surface Area	205
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	6
Heavy Atom Count	50
Formal Charge	0
Complexity	1160

SMILES

CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)O)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O

InChI

InChI=1S/C36H65NO13/c1-13-24-36(10,45)29(40)19(4)26(38)17(2)15-35(9,44)31(50-33-27(39)23(37(11)12)14-18(3)46-33)20(5)28(21(6)32(42)48-24)49-25-16-34(8,43)30(41)22(7)47-25/h17-25,27-31,33,39-41,43-45H,13-16H2,1-12H3/t17-,18-,19+,20+,21-,22+,23+,24-,25+,27-,28+,29-,30+,31-,33+,34-,35-,36-/m1/s1

InChIKey

MWFRKHPRXPSWNT-QNPWSHAKSA-N

Chemical Structure

2D Structure

CAS: 1675-02-1

CID: 83933

Formula: C36H65NO13

MW: 719.9

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	719.9
XLogP3	2.2
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	6
Exact Mass	719.44559113
Monoisotopic Mass	719.44559113
Topological Polar Surface Area	205 Å²
Heavy Atom Count	50
Formal Charge	0
Complexity	1160
Isotope Atom Count	0
Defined Atom Stereocenter Count	18
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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