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

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H43NO8
Molecular Weight 509.6322
Optical Activity UNSPECIFIED
Defined Stereocenters 14 / 14
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CEVINE

SMILES

[H][C@@]12CC[C@@]3([H])[C@]4(O)C[C@H](O)[C@@]5(O)[C@@]([H])(CN6C[C@@H](C)CC[C@@]6([H])[C@@]5(C)O)[C@]4(O)C[C@@]37O[C@]1(O)[C@H](O)CC[C@@]27C

InChI

InChIKey=MZHXYVMEVBEFAL-BDDFMVBUSA-N
InChI=1S/C27H43NO8/c1-14-4-7-18-22(3,31)26(34)17(12-28(18)11-14)24(33)13-25-16(23(24,32)10-20(26)30)6-5-15-21(25,2)9-8-19(29)27(15,35)36-25/h14-20,29-35H,4-13H2,1-3H3/t14-,15-,16-,17-,18-,19+,20-,21-,22+,23+,24+,25+,26-,27?/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H43NO8
Molecular Weight 509.6322
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 14 / 14
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:25:31 GMT 2023
Edited
by admin
on Sat Dec 16 08:25:31 GMT 2023
Record UNII
WTW6CVN18U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CEVINE
MI  
Common Name English
CEVANE-3,4,12,14,16,17,20-HEPTOL, 4,9-EPOXY-, (3.ALPHA.,4.ALPHA.,16.BETA.)-
Systematic Name English
NSC-99804
Code English
SABADININE
Common Name English
CEVIN
Common Name English
CEVINE [MI]
Common Name English
Code System Code Type Description
CHEBI
35652
Created by admin on Sat Dec 16 08:25:31 GMT 2023 , Edited by admin on Sat Dec 16 08:25:31 GMT 2023
PRIMARY
CAS
124-98-1
Created by admin on Sat Dec 16 08:25:31 GMT 2023 , Edited by admin on Sat Dec 16 08:25:31 GMT 2023
PRIMARY
NSC
99804
Created by admin on Sat Dec 16 08:25:31 GMT 2023 , Edited by admin on Sat Dec 16 08:25:31 GMT 2023
PRIMARY
MERCK INDEX
m3304
Created by admin on Sat Dec 16 08:25:31 GMT 2023 , Edited by admin on Sat Dec 16 08:25:31 GMT 2023
PRIMARY Merck Index
FDA UNII
WTW6CVN18U
Created by admin on Sat Dec 16 08:25:31 GMT 2023 , Edited by admin on Sat Dec 16 08:25:31 GMT 2023
PRIMARY
PUBCHEM
6857494
Created by admin on Sat Dec 16 08:25:31 GMT 2023 , Edited by admin on Sat Dec 16 08:25:31 GMT 2023
PRIMARY
ECHA (EC/EINECS)
204-720-8
Created by admin on Sat Dec 16 08:25:31 GMT 2023 , Edited by admin on Sat Dec 16 08:25:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID40924675
Created by admin on Sat Dec 16 08:25:31 GMT 2023 , Edited by admin on Sat Dec 16 08:25:31 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT