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

Details

Stereochemistry UNKNOWN
Molecular Formula C29H34O10
Molecular Weight 542.5743
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 13
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7.BETA.,8.BETA.-2',3'-DIEPOXYRORIDIN H

SMILES

C[C@H]1OC2CC3(C)OC3C(=O)OC[C@]45[C@H]6O[C@H]6C(C)=C[C@H]4O[C@@H]7C[C@@H](OC(=O)C=C\C=C\[C@H]1O2)[C@@]5(C)[C@]78CO8

InChI

InChIKey=JIOIZCCNKQQRDN-LIXLHTEBSA-N
InChI=1S/C29H34O10/c1-14-9-18-28(23-22(14)38-23)12-32-25(31)24-26(3,39-24)11-21-34-15(2)16(35-21)7-5-6-8-20(30)37-17-10-19(36-18)29(13-33-29)27(17,28)4/h5-9,15-19,21-24H,10-13H2,1-4H3/b7-5+,8-6-/t15-,16-,17-,18-,19-,21?,22+,23+,24?,26?,27-,28-,29+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
7BETA,8BETA-2',3'-DIEPOXYRORIDIN H
Preferred Name English
7.BETA.,8.BETA.-2',3'-DIEPOXYRORIDIN H
Common Name English
VERRUCARIN A, 7'-DEOXO-2'-DEOXY-2',3':7,8-DIEPOXY-7',5'-(ETHYLIDENEOXY)-, (7R,8S)-
Systematic Name English
Code System Code Type Description
CAS
64687-84-9
Created by admin on Wed Apr 02 13:21:15 GMT 2025 , Edited by admin on Wed Apr 02 13:21:15 GMT 2025
PRIMARY
PUBCHEM
123133513
Created by admin on Wed Apr 02 13:21:15 GMT 2025 , Edited by admin on Wed Apr 02 13:21:15 GMT 2025
PRIMARY
FDA UNII
Y96320SM3Z
Created by admin on Wed Apr 02 13:21:15 GMT 2025 , Edited by admin on Wed Apr 02 13:21:15 GMT 2025
PRIMARY