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

Details

Stereochemistry ABSOLUTE
Molecular Formula C26H29NO5
Molecular Weight 435.5122
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VERTINE

SMILES

[H][C@]12C[C@@]3([H])CCCCN3[C@@]([H])(C1)C4=CC(OC)=C(OC)C=C4C5=CC(=CC=C5O)C=CC(=O)O2

InChI

InChIKey=WCZWUYYJZVBKDZ-VMSBZHFZSA-N
InChI=1S/C26H29NO5/c1-30-24-14-19-20(15-25(24)31-2)22-13-18(12-17-5-3-4-10-27(17)22)32-26(29)9-7-16-6-8-23(28)21(19)11-16/h6-9,11,14-15,17-18,22,28H,3-5,10,12-13H2,1-2H3/b9-7-/t17-,18+,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula C26H29NO5
Molecular Weight 435.5122
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:47:08 GMT 2023
Edited
by admin
on Sat Dec 16 01:47:08 GMT 2023
Record UNII
OR77C8W8TA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VERTINE
Common Name English
(+)-VERTINE
Common Name English
20H-6,20-METHANO-11,15-METHENO-1H,8H-BENZO(G)PYRIDO(2,1-D)(1,5)OXAAZACYCLOHEXADECIN-8-ONE, 2,3,4,4A,5,6-HEXAHYDRO-14-HYDROXY-17,18-DIMETHOXY-, (4AR,6S,9Z,20S)-
Systematic Name English
CRYOGENINE
Common Name English
LYTHRAN-12-ONE, 2'-HYDROXY-4'',5''-DIMETHOXY-, (10.ALPHA.)-
Common Name English
VERTINE, (+)-
Common Name English
(10.ALPHA.)-4,5-DIMETHOXY-2-HYDROXYLYTHRAN-12-ONE
Common Name English
NSC-272693
Code English
(4AR,6S,9Z,20S)-2,3,4,4A,5,6-HEXAHYDRO-14-HYDROXY-17,18-DIMETHOXY-20H-6,20-METHANO-11,15-METHENO-1H,8H-BENZO(G)PYRIDO(2,1-D)(1,5)OXAAZACYCLOHEXADECIN-8-ONE
Systematic Name English
Code System Code Type Description
CHEBI
3929
Created by admin on Sat Dec 16 01:47:08 GMT 2023 , Edited by admin on Sat Dec 16 01:47:08 GMT 2023
PRIMARY
NSC
272693
Created by admin on Sat Dec 16 01:47:08 GMT 2023 , Edited by admin on Sat Dec 16 01:47:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID20109997
Created by admin on Sat Dec 16 01:47:08 GMT 2023 , Edited by admin on Sat Dec 16 01:47:08 GMT 2023
PRIMARY
CAS
10308-13-1
Created by admin on Sat Dec 16 01:47:08 GMT 2023 , Edited by admin on Sat Dec 16 01:47:08 GMT 2023
PRIMARY
PUBCHEM
5315204
Created by admin on Sat Dec 16 01:47:08 GMT 2023 , Edited by admin on Sat Dec 16 01:47:08 GMT 2023
PRIMARY
WIKIPEDIA
CRYOGENINE
Created by admin on Sat Dec 16 01:47:08 GMT 2023 , Edited by admin on Sat Dec 16 01:47:08 GMT 2023
PRIMARY
FDA UNII
OR77C8W8TA
Created by admin on Sat Dec 16 01:47:08 GMT 2023 , Edited by admin on Sat Dec 16 01:47:08 GMT 2023
PRIMARY