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

Details

Stereochemistry ABSOLUTE
Molecular Formula C23H31NO
Molecular Weight 337.4983
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of XORPHANOL

SMILES

[H][C@@]12[C@@H](C)CC(=C)C[C@@]13CCN(CC4CCC4)[C@@H]2CC5=CC=C(O)C=C35

InChI

InChIKey=AZJPPZHRNFQRRE-AZIXLERZSA-N
InChI=1S/C23H31NO/c1-15-10-16(2)22-21-11-18-6-7-19(25)12-20(18)23(22,13-15)8-9-24(21)14-17-4-3-5-17/h6-7,12,16-17,21-22,25H,1,3-5,8-11,13-14H2,2H3/t16-,21+,22-,23+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
XORPHANOL
INN  
INN  
Official Name English
xorphanol [INN]
Common Name English
17-(CYCLOBUTYLMETHYL)-8.BETA.-METHYL-6-METHYLENEMORPHINAN-3-OL
Systematic Name English
TR 5379
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C241
Created by admin on Fri Dec 15 16:40:44 UTC 2023 , Edited by admin on Fri Dec 15 16:40:44 UTC 2023
NCI_THESAURUS C1506
Created by admin on Fri Dec 15 16:40:44 UTC 2023 , Edited by admin on Fri Dec 15 16:40:44 UTC 2023
Code System Code Type Description
ChEMBL
CHEMBL2111060
Created by admin on Fri Dec 15 16:40:44 UTC 2023 , Edited by admin on Fri Dec 15 16:40:44 UTC 2023
PRIMARY
EPA CompTox
DTXSID001018240
Created by admin on Fri Dec 15 16:40:44 UTC 2023 , Edited by admin on Fri Dec 15 16:40:44 UTC 2023
PRIMARY
PUBCHEM
5488631
Created by admin on Fri Dec 15 16:40:44 UTC 2023 , Edited by admin on Fri Dec 15 16:40:44 UTC 2023
PRIMARY
SMS_ID
100000079361
Created by admin on Fri Dec 15 16:40:44 UTC 2023 , Edited by admin on Fri Dec 15 16:40:44 UTC 2023
PRIMARY
NCI_THESAURUS
C152935
Created by admin on Fri Dec 15 16:40:44 UTC 2023 , Edited by admin on Fri Dec 15 16:40:44 UTC 2023
PRIMARY
INN
5269
Created by admin on Fri Dec 15 16:40:44 UTC 2023 , Edited by admin on Fri Dec 15 16:40:44 UTC 2023
PRIMARY
WIKIPEDIA
XORPHANOL
Created by admin on Fri Dec 15 16:40:44 UTC 2023 , Edited by admin on Fri Dec 15 16:40:44 UTC 2023
PRIMARY
EVMPD
SUB00118MIG
Created by admin on Fri Dec 15 16:40:44 UTC 2023 , Edited by admin on Fri Dec 15 16:40:44 UTC 2023
PRIMARY
CAS
77287-89-9
Created by admin on Fri Dec 15 16:40:44 UTC 2023 , Edited by admin on Fri Dec 15 16:40:44 UTC 2023
PRIMARY
FDA UNII
L415991P58
Created by admin on Fri Dec 15 16:40:44 UTC 2023 , Edited by admin on Fri Dec 15 16:40:44 UTC 2023
PRIMARY