U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H25NO9.ClH
Molecular Weight 519.928
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMRUBICIN HYDROCHLORIDE

SMILES

Cl.[H][C@@]1(C[C@H](O)[C@H](O)CO1)O[C@H]2C[C@@](N)(CC3=C(O)C4=C(C(=O)C5=CC=CC=C5C4=O)C(O)=C23)C(C)=O

InChI

InChIKey=BHMLHEQFWVQAJS-IITOGVPQSA-N
InChI=1S/C25H25NO9.ClH/c1-10(27)25(26)7-13-18(16(8-25)35-17-6-14(28)15(29)9-34-17)24(33)20-19(23(13)32)21(30)11-4-2-3-5-12(11)22(20)31;/h2-5,14-17,28-29,32-33H,6-9,26H2,1H3;1H/t14-,15+,16-,17-,25-;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
AMRUBICIN HYDROCHLORIDE
JAN   MI   USAN   WHO-DD  
USAN  
Official Name English
SM-5887
Code English
CALSED
Brand Name English
Amrubicin hydrochloride [WHO-DD]
Common Name English
AMRUBICIN HYDROCHLORIDE [MI]
Common Name English
(+)-(7S,9S)-9-ACETYL-9-AMINO-7-((2-DEOXY-.BETA.-D-ERYTHRO-PENTOPYRANOSYL)OXY)-6,11-DIHYDROXY-7,8,9,10-TETRAHYDROTETRACENE-5,12-DIONE HYDROCHLORIDE
Common Name English
AMRUBICIN HYDROCHLORIDE [JAN]
Common Name English
SM 5887
Code English
AMRUBICIN HYDROCHLORIDE [USAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C1594
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
EU-Orphan Drug EU/3/08/538
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
Code System Code Type Description
FDA UNII
EUL6MP8FZW
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
PRIMARY
CHEBI
135779
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
PRIMARY
MERCK INDEX
m1858
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
PRIMARY Merck Index
DRUG BANK
DBSALT001934
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
PRIMARY
PUBCHEM
114897
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
PRIMARY
EVMPD
SUB20586
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
PRIMARY
NCI_THESAURUS
C47948
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
PRIMARY
CAS
110311-30-3
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
PRIMARY
ChEMBL
CHEMBL1186894
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
PRIMARY
EPA CompTox
DTXSID10911577
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
PRIMARY
SMS_ID
100000085964
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
PRIMARY
USAN
TT-122
Created by admin on Fri Dec 15 16:25:42 UTC 2023 , Edited by admin on Fri Dec 15 16:25:42 UTC 2023
PRIMARY