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

Details

Stereochemistry ABSOLUTE
Molecular Formula C32H43N5O5
Molecular Weight 577.7143
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-DIHYDROERGOCRYPTINE

SMILES

[H][C@@]12CCCN1C(=O)[C@H]([C@@H](C)CC)N3C(=O)[C@](NC(=O)[C@H]4CN(C)[C@]5([H])CC6=CNC7=CC=CC(=C67)[C@@]5([H])C4)(O[C@@]23O)C(C)C

InChI

InChIKey=SBFXHXZNBNFPHV-PSELOKDRSA-N
InChI=1S/C32H43N5O5/c1-6-18(4)27-29(39)36-12-8-11-25(36)32(41)37(27)30(40)31(42-32,17(2)3)34-28(38)20-13-22-21-9-7-10-23-26(21)19(15-33-23)14-24(22)35(5)16-20/h7,9-10,15,17-18,20,22,24-25,27,33,41H,6,8,11-14,16H2,1-5H3,(H,34,38)/t18-,20+,22+,24+,25-,27-,31+,32-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
.BETA.-DIHYDROERGOCRYPTINE
Common Name English
9,10-DIHYDRO-.BETA.-ERGOCRYPTINE
Common Name English
.BETA.-ERGOCRYPTINE, 9,10-DIHYDRO-
Common Name English
DIHYDRO-.BETA.-ERGOCRYPTIN
Common Name English
.BETA.-ERGOCRYPTINE, DIHYDRO-
Common Name English
ERGOTAMAN-3',6',18-TRIONE, 9,10-DIHYDRO-12'-HYDROXY-2'-(1-METHYLETHYL)-5'-((1S)-1-METHYLPROPYL)-, (5'.ALPHA.,10.ALPHA.)-
Systematic Name English
Dihydroergocryptine, beta-isomer [WHO-DD]
Common Name English
DIHYDROERGOCRYPTINE, BETA-ISOMER
WHO-DD  
Common Name English
Code System Code Type Description
FDA UNII
H6EBC7Y4PM
Created by admin on Sat Dec 16 08:29:53 GMT 2023 , Edited by admin on Sat Dec 16 08:29:53 GMT 2023
PRIMARY
EPA CompTox
DTXSID90941216
Created by admin on Sat Dec 16 08:29:53 GMT 2023 , Edited by admin on Sat Dec 16 08:29:53 GMT 2023
PRIMARY
CHEBI
59925
Created by admin on Sat Dec 16 08:29:53 GMT 2023 , Edited by admin on Sat Dec 16 08:29:53 GMT 2023
PRIMARY
PUBCHEM
5282321
Created by admin on Sat Dec 16 08:29:53 GMT 2023 , Edited by admin on Sat Dec 16 08:29:53 GMT 2023
PRIMARY
WIKIPEDIA
beta-Dihydroergocryptine
Created by admin on Sat Dec 16 08:29:53 GMT 2023 , Edited by admin on Sat Dec 16 08:29:53 GMT 2023
PRIMARY
CAS
19467-62-0
Created by admin on Sat Dec 16 08:29:53 GMT 2023 , Edited by admin on Sat Dec 16 08:29:53 GMT 2023
PRIMARY