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Details

Stereochemistry ABSOLUTE
Molecular Formula C72H101N17O26
Molecular Weight 1620.6706
Optical Activity UNSPECIFIED
Defined Stereocenters 13 / 13
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DAPTOMYCIN

SMILES

CCCCCCCCCC(=O)N[C@@H](CC1=CNC2=C1C=CC=C2)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@H]3[C@@H](C)OC(=O)[C@H](CC(=O)C4=CC=CC=C4N)NC(=O)[C@@H](NC(=O)[C@@H](CO)NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCN)NC(=O)CNC3=O)[C@H](C)CC(O)=O

InChI

InChIKey=DOAKLVKFURWEDJ-QCMAZARJSA-N
InChI=1S/C72H101N17O26/c1-5-6-7-8-9-10-11-22-53(93)81-44(25-38-31-76-42-20-15-13-17-39(38)42)66(108)84-45(27-52(75)92)67(109)86-48(30-59(102)103)68(110)89-61-37(4)115-72(114)49(26-51(91)40-18-12-14-19-41(40)74)87-71(113)60(35(2)24-56(96)97)88-69(111)50(34-90)82-55(95)32-77-63(105)46(28-57(98)99)83-62(104)36(3)79-65(107)47(29-58(100)101)85-64(106)43(21-16-23-73)80-54(94)33-78-70(61)112/h12-15,17-20,31,35-37,43-50,60-61,76,90H,5-11,16,21-30,32-34,73-74H2,1-4H3,(H2,75,92)(H,77,105)(H,78,112)(H,79,107)(H,80,94)(H,81,93)(H,82,95)(H,83,104)(H,84,108)(H,85,106)(H,86,109)(H,87,113)(H,88,111)(H,89,110)(H,96,97)(H,98,99)(H,100,101)(H,102,103)/t35-,36-,37-,43+,44+,45-,46+,47+,48+,49+,50-,60+,61+/m1/s1

HIDE SMILES / InChI

Molecular Formula C72H101N17O26
Molecular Weight 1620.6706
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 13 / 13
E/Z Centers 4
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:00:48 UTC 2023
Edited
by admin
on Sat Dec 16 17:00:48 UTC 2023
Record UNII
NWQ5N31VKK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DAPTOMYCIN
EMA EPAR   INN   JAN   MART.   MI   ORANGE BOOK   USAN   VANDF   WHO-DD  
INN   USAN  
Official Name English
DAPTOMYCIN [MI]
Common Name English
LY-146032
Code English
CUBICIN
Brand Name English
CIDECIN
Brand Name English
DAPTOMYCIN [MART.]
Common Name English
DAPTOMYCIN [ORANGE BOOK]
Common Name English
daptomycin [INN]
Common Name English
DAPZURA RT
Brand Name English
LY 146032
Code English
DAPTOMYCIN [USAN]
Common Name English
DAPTOMYCIN [EMA EPAR]
Common Name English
LY-164032
Code English
N-DECANOYL-L-TRYPTOPHYL-L-ASPARAGINYL-L-ASPARTYL-L-THREONYLGLYCYL-L-ORNITHYL-L-ASPARTYL-D-ALANYL-L-ASPARTYLGLYCYL-D-SERYL-THREO-3-METHYL-L-GLUTAMYL-3-ANTHRANILOYL-L-ALANINE E1-LACTONE
Common Name English
DAPTOMYCIN [JAN]
Common Name English
Daptomycin [WHO-DD]
Common Name English
DAPCIN
Brand Name English
DAPTOMYCIN [VANDF]
Common Name English
Classification Tree Code System Code
NDF-RT N0000175509
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
NDF-RT N0000175508
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
WHO-VATC QJ01XX09
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
NCI_THESAURUS C2363
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
EMA ASSESSMENT REPORTS CUBICIN (AUTHORIZED: ENDOCARDITIS, BACTERIAL)
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
WHO-ATC J01XX09
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
EMA ASSESSMENT REPORTS CUBICIN (AUTHORIZED: BACTEREMIA)
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
NDF-RT N0000175508
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
LIVERTOX NBK548746
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
Code System Code Type Description
DAILYMED
NWQ5N31VKK
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
FDA UNII
NWQ5N31VKK
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
PUBCHEM
21585658
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
DRUG CENTRAL
783
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
EPA CompTox
DTXSID1041009
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
RXCUI
22299
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY RxNorm
USAN
Y-79
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
LACTMED
Daptomycin
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
MESH
D017576
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
NCI_THESAURUS
C47470
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
DRUG BANK
DB00080
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
CHEBI
600103
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
EVMPD
SUB06910MIG
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
WIKIPEDIA
DAPTOMYCIN
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
ChEMBL
CHEMBL387675
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
CAS
103060-53-3
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
MERCK INDEX
m4093
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY Merck Index
INN
6127
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
SMS_ID
100000085430
Created by admin on Sat Dec 16 17:00:49 UTC 2023 , Edited by admin on Sat Dec 16 17:00:49 UTC 2023
PRIMARY
Related Record Type Details
TARGET ORGANISM->INHIBITOR
METABOLIC ENZYME -> NON-INHIBITOR
BINDER->LIGAND
BINDING
Related Record Type Details
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
Volume of Distribution PHARMACOKINETIC
Biological Half-life PHARMACOKINETIC