phone
Email
Online Inquiry
Verification code

Doxycycline calcium

Catalog Number
ACM94088854
CAS
94088-85-4
Structure
IUPAC Name
dicalcium (5R,5aR,6S,6aR,7S,9Z,10aS)-9-[amino(hydroxy)methylidene]-7-(dimethylamino)-5-methyl-8,10,11-trioxo-5a,6,6a,7-tetrahydro-5H-tetracene-1,6,10a,12-tetrolate
Synonyms
2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, calcium salt (1:2), (4S-(4alpha,4aalpha,5alpha,5aalpha,6alpha,12aalpha))-
Molecular Weight
520.56
Molecular Formula
C22H20Ca2N2O8
Canonical SMILES
CC1C2C(C3C(C(=C(C(=O)C3(C(=C2C(=O)C4=C1C=CC=C4[O-])[O-])[O-])C(=O)N)[O-])N(C)C)O.[Ca+2].[Ca+2]
InChI Key
PFWWMPJQWJGIAO-TWUUVKLJSA-L
Boiling Point
685.2ºC at 760mmHg
Flash Point
368.2ºC
Purity
96%
Density
g/cm³
Actives
95%
Physical State
Solid
Typical Applications
Use as antimicrobial agent, antibacterial agent.
Use as pharmaceutical ingredient (antibiotic) (For reference only).
Spec Sheet
Custom Q&A

What is the PubChem CID for doxycycline calcium?

The PubChem CID for doxycycline calcium is 54675779.

What is the molecular formula of doxycycline calcium?

The molecular formula of doxycycline calcium is C22H24N2O9.

What is the molecular weight of doxycycline calcium?

The molecular weight of doxycycline calcium is 460.4 g/mol.

What are some synonyms for doxycycline calcium?

Some synonyms for doxycycline calcium include oxytetracycline, Terramycin, and Oxyterracine.

What is the IUPAC name of doxycycline calcium?

The IUPAC name of doxycycline calcium is (4S,4aR,5S,5aR,6S,12aR)-4-(dimethylamino)-1,5,6,10,11,12a-hexahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide.

What is the InChI of doxycycline calcium?

The InChI of doxycycline calcium is InChI=1S/C22H24N2O9/c1-21(32)7-5-4-6-8(25)9(7)15(26)10-12(21)17(28)13-14(24(2)3)16(27)11(20(23)31)19(30)22(13,33)18(10)29/h4-6,12-14,17,25-26,28,30,32-33H,1-3H3,(H2,23,31)/t12-,13-,14+,17+,21-,22+/m1/s1.

What is the CAS number for doxycycline calcium?

The CAS number for doxycycline calcium is 79-57-2.

What is the ChEBI ID of doxycycline calcium?

The ChEBI ID of doxycycline calcium is CHEMBL1517.

What is the UNII for doxycycline calcium?

The UNII for doxycycline calcium is SLF0D9077S.

What is the KEGG ID for doxycycline calcium?

The KEGG ID for doxycycline calcium is C06624.

※Please kindly note that our products are for research use only.

PAGE TOP