Feedback

carindacillin sodium

Properties

Image

Occurences in reactions

MNX_ID

MNXM120281

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₆H₂₅N₂NaO₆S

charge

mass

516.1331

reference

chebi:31358

InChIKey

QFWPXOXWAUAYAB-XZVIDJSISA-M

InChI

InChI=1S/C26H26N2O6S.Na/c1-26(2)20(24(31)32)28-22(30)19(23(28)35-26)27-21(29)18(15-7-4-3-5-8-15)25(33)34-17-12-11-14-9-6-10-16(14)13-17;/h3-5,7-8,11-13,18-20,23H,6,9-10H2,1-2H3,(H,27,29)(H,31,32);/q;+1/p-1/t18?,19-,20+,23-;/m1./s1

SMILES

CC1(C)S[C@@H]2[C@H](NC(=O)C(C(=O)Oc3ccc4c(c3)CCC4)c3ccccc3)C(=O)N2[C@H]1C(=O)[O-].[Na+]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:31358 chebi:31358	carindacillin sodium Carbenicillin indanyl sodium Carindacillin sodium Geocillin indanyl carbenicillin sodium salt sodium (2S,5R,6R)-6-{[3-(2,3-dihydro-1H-inden-5-yloxy)-3-oxo-2-phenylpropanoyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate sodium 5-indanylcarbenicillin sodium 6beta-[3-(2,3-dihydro-1H-inden-5-yloxy)-3-oxo-2-phenylpropanamido]-2,2-dimethylpenam-3alpha-carboxylate sodium 6beta-{2-[(2,3-dihydro-1H-inden-5-yloxy)carbonyl]-2-phenylacetamido}-2,2-dimethylpenam-3alpha-carboxylate
kegg.drug:D01283 keggD:D01283	Carbenicillin indanyl sodium (USP) Carindacillin sodium (JAN) Geocillin (TN)
seed.compound:cpd09296 seedM:cpd09296 kegg.compound:C12712 keggC:C12712	Carindacillin sodium Carbenicillin indanyl sodium
keggC:M_C12712 keggD:M_D01283 seedM:M_cpd09296	secondary/obsolete/fantasy identifier