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

Details

Stereochemistry EPIMERIC
Molecular Formula C76H52O46.C16H19ClN2
Molecular Weight 1975.987
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CHLORPHENIRAMINE TANNATE

SMILES

CN(C)CCC(C1=CC=C(Cl)C=C1)C2=CC=CC=N2.OC3=CC(=CC(O)=C3O)C(=O)OC4=CC(=CC(O)=C4O)C(=O)OC[C@H]5O[C@@H](OC(=O)C6=CC(O)=C(O)C(OC(=O)C7=CC(O)=C(O)C(O)=C7)=C6)[C@H](OC(=O)C8=CC(O)=C(O)C(OC(=O)C9=CC(O)=C(O)C(O)=C9)=C8)[C@@H](OC(=O)C%10=CC(O)=C(O)C(OC(=O)C%11=CC(O)=C(O)C(O)=C%11)=C%10)[C@@H]5OC(=O)C%12=CC(O)=C(O)C(OC(=O)C%13=CC(O)=C(O)C(O)=C%13)=C%12

InChI

InChIKey=KOOFUFFGNZKXFG-HBNMXAOGSA-N
InChI=1S/C76H52O46.C16H19ClN2/c77-32-1-22(2-33(78)53(32)92)67(103)113-47-16-27(11-42(87)58(47)97)66(102)112-21-52-63(119-72(108)28-12-43(88)59(98)48(17-28)114-68(104)23-3-34(79)54(93)35(80)4-23)64(120-73(109)29-13-44(89)60(99)49(18-29)115-69(105)24-5-36(81)55(94)37(82)6-24)65(121-74(110)30-14-45(90)61(100)50(19-30)116-70(106)25-7-38(83)56(95)39(84)8-25)76(118-52)122-75(111)31-15-46(91)62(101)51(20-31)117-71(107)26-9-40(85)57(96)41(86)10-26;1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h1-20,52,63-65,76-101H,21H2;3-9,11,15H,10,12H2,1-2H3/t52-,63-,64+,65-,76+;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CHLORPHENIRAMINE TANNATE
VANDF  
Common Name English
CHLORPHENAMINE TANNATE
WHO-DD  
Common Name English
CHLORPHENAMINE TANNATE [WHO-DD]
Common Name English
CHLORPHENIRAMINE TANNATE [VANDF]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29578
Created by admin on Sat Dec 16 03:27:56 UTC 2023 , Edited by admin on Sat Dec 16 03:27:56 UTC 2023
Code System Code Type Description
RXCUI
221075
Created by admin on Sat Dec 16 03:27:56 UTC 2023 , Edited by admin on Sat Dec 16 03:27:56 UTC 2023
PRIMARY RxNorm
ECHA (EC/EINECS)
215-782-0
Created by admin on Sat Dec 16 03:27:56 UTC 2023 , Edited by admin on Sat Dec 16 03:27:56 UTC 2023
PRIMARY
PUBCHEM
71586779
Created by admin on Sat Dec 16 03:27:56 UTC 2023 , Edited by admin on Sat Dec 16 03:27:56 UTC 2023
PRIMARY
SMS_ID
100000084736
Created by admin on Sat Dec 16 03:27:56 UTC 2023 , Edited by admin on Sat Dec 16 03:27:56 UTC 2023
PRIMARY
CAS
1405-56-7
Created by admin on Sat Dec 16 03:27:56 UTC 2023 , Edited by admin on Sat Dec 16 03:27:56 UTC 2023
PRIMARY
EPA CompTox
DTXSID90161417
Created by admin on Sat Dec 16 03:27:56 UTC 2023 , Edited by admin on Sat Dec 16 03:27:56 UTC 2023
PRIMARY
NCI_THESAURUS
C97692
Created by admin on Sat Dec 16 03:27:56 UTC 2023 , Edited by admin on Sat Dec 16 03:27:56 UTC 2023
PRIMARY
FDA UNII
72JT935YTT
Created by admin on Sat Dec 16 03:27:56 UTC 2023 , Edited by admin on Sat Dec 16 03:27:56 UTC 2023
PRIMARY
EVMPD
SUB01244MIG
Created by admin on Sat Dec 16 03:27:56 UTC 2023 , Edited by admin on Sat Dec 16 03:27:56 UTC 2023
PRIMARY
DRUG BANK
DBSALT001556
Created by admin on Sat Dec 16 03:27:56 UTC 2023 , Edited by admin on Sat Dec 16 03:27:56 UTC 2023
PRIMARY