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Details

Stereochemistry ABSOLUTE
Molecular Formula C42H64N2.2C16H18N2O4S
Molecular Weight 1265.751
Optical Activity UNSPECIFIED
Defined Stereocenters 12 / 12
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PENICILLIN G HYDRABAMINE

SMILES

[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)CC3=CC=CC=C3)C(O)=O.[H][C@]45SC(C)(C)[C@@H](N4C(=O)[C@H]5NC(=O)CC6=CC=CC=C6)C(O)=O.[H][C@@]78CCC9=C(C=CC(=C9)C(C)C)[C@@]7(C)CCC[C@@]8(C)CNCCNC[C@]%10(C)CCC[C@]%11(C)C%12=C(CC[C@@]%10%11[H])C=C(C=C%12)C(C)C

InChI

InChIKey=BIPGVSDEAYGJOG-YQUITFMISA-N
InChI=1S/C42H64N2.2C16H18N2O4S/c1-29(2)31-11-15-35-33(25-31)13-17-37-39(5,19-9-21-41(35,37)7)27-43-23-24-44-28-40(6)20-10-22-42(8)36-16-12-32(30(3)4)26-34(36)14-18-38(40)42;2*1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9/h11-12,15-16,25-26,29-30,37-38,43-44H,9-10,13-14,17-24,27-28H2,1-8H3;2*3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t37-,38-,39-,40-,41+,42+;2*11-,12+,14-/m011/s1

HIDE SMILES / InChI

Molecular Formula C42H64N2
Molecular Weight 596.971
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C16H18N2O4S
Molecular Weight 334.39
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

PENICILLIN G HYDRABAMINE, a semi-synthetic antibiotic, is used for the treatment of infections caused by susceptible, usually gram-positive, organisms.

Approval Year

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
Curative
Compocillin

Approved Use

Antibacterial
Cmax

Cmax

ValueDoseCo-administeredAnalytePopulation
145.5 μg/mL
30 mg/kg 2 times / day multiple, intravenous
dose: 30 mg/kg
route of administration: Intravenous
experiment type: MULTIPLE
co-administered:
PENICILLIN G plasma
Homo sapiens
population: UNHEALTHY
age: NEWBORN
sex: FEMALE / MALE
food status: UNKNOWN
AUC

AUC

ValueDoseCo-administeredAnalytePopulation
23360.2 μg × min/mL
30 mg/kg 2 times / day multiple, intravenous
dose: 30 mg/kg
route of administration: Intravenous
experiment type: MULTIPLE
co-administered:
PENICILLIN G plasma
Homo sapiens
population: UNHEALTHY
age: NEWBORN
sex: FEMALE / MALE
food status: UNKNOWN
T1/2

T1/2

ValueDoseCo-administeredAnalytePopulation
3.8 h
30 mg/kg 2 times / day multiple, intravenous
dose: 30 mg/kg
route of administration: Intravenous
experiment type: MULTIPLE
co-administered:
PENICILLIN G plasma
Homo sapiens
population: UNHEALTHY
age: NEWBORN
sex: FEMALE / MALE
food status: UNKNOWN
Funbound

Funbound

ValueDoseCo-administeredAnalytePopulation
40%
30 mg/kg 2 times / day multiple, intravenous
dose: 30 mg/kg
route of administration: Intravenous
experiment type: MULTIPLE
co-administered:
PENICILLIN G plasma
Homo sapiens
population: UNHEALTHY
age: NEWBORN
sex: FEMALE / MALE
food status: UNKNOWN
Overview

Overview

CYP3A4CYP2C9CYP2D6hERG

OverviewOther

Other InhibitorOther SubstrateOther Inducer






Drug as perpetrator​Drug as victim

Drug as victim

TargetModalityActivityMetaboliteClinical evidence
likely
PubMed

PubMed

TitleDatePubMed
Hydrabamine penicillin G: a new oral penicillin.
1955 Jul
Penicillin G, penicillin V, and other pharmaceutical improvements in the treatment of infections.
1990 Jan-Feb
Substance Class Chemical
Created
by admin
on Wed Jul 05 22:29:51 UTC 2023
Edited
by admin
on Wed Jul 05 22:29:51 UTC 2023
Record UNII
667Y1107D3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PENICILLIN G HYDRABAMINE
MI   WHO-DD  
Common Name English
PENICILLIN G HYDRABAMINE [MI]
Common Name English
Penicillin g hydrabamine [WHO-DD]
Common Name English
Code System Code Type Description
PUBCHEM
76964871
Created by admin on Wed Jul 05 22:29:51 UTC 2023 , Edited by admin on Wed Jul 05 22:29:51 UTC 2023
PRIMARY
EPA CompTox
DTXSID20187084
Created by admin on Wed Jul 05 22:29:51 UTC 2023 , Edited by admin on Wed Jul 05 22:29:51 UTC 2023
PRIMARY
FDA UNII
667Y1107D3
Created by admin on Wed Jul 05 22:29:51 UTC 2023 , Edited by admin on Wed Jul 05 22:29:51 UTC 2023
PRIMARY
CAS
3344-16-9
Created by admin on Wed Jul 05 22:29:51 UTC 2023 , Edited by admin on Wed Jul 05 22:29:51 UTC 2023
PRIMARY
ECHA (EC/EINECS)
222-092-3
Created by admin on Wed Jul 05 22:29:51 UTC 2023 , Edited by admin on Wed Jul 05 22:29:51 UTC 2023
PRIMARY
MERCK INDEX
M385
Created by admin on Wed Jul 05 22:29:51 UTC 2023 , Edited by admin on Wed Jul 05 22:29:51 UTC 2023
PRIMARY Merck Index
EVMPD
SUB14790MIG
Created by admin on Wed Jul 05 22:29:51 UTC 2023 , Edited by admin on Wed Jul 05 22:29:51 UTC 2023
PRIMARY
SMS_ID
100000079754
Created by admin on Wed Jul 05 22:29:51 UTC 2023 , Edited by admin on Wed Jul 05 22:29:51 UTC 2023
PRIMARY
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