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

Details

Stereochemistry ABSOLUTE
Molecular Formula C58H83NO17
Molecular Weight 1066.2761
Optical Activity UNSPECIFIED
Defined Stereocenters 31 / 31
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of E-7130

SMILES

C[C@H]1C[C@@]2(C[C@H](C)[C@@H]3O[C@H](CN)[C@H](O)C[C@@H]3O2)O[C@H]4C[C@]5(C[C@H]6O[C@H]7[C@H](C)[C@H]8OC(=O)C[C@H]9CC[C@@H]%10O[C@H]%11[C@H]%12O[C@@]%13(C[C@@H]%12O[C@H]%11[C@@H](O%13)[C@H]%10O9)CC[C@H]%14CC(=C)[C@H](CC[C@H]%15C[C@@H](C)C(=C)[C@@H](C[C@@H]8O[C@H]7C[C@H]6O5)O%15)O%14)O[C@@H]14

InChI

InChIKey=MJMBDBINYFNDST-UWJPGFHWSA-N
InChI=1S/C58H83NO17/c1-25-13-31-7-9-35-26(2)14-33(62-35)11-12-56-22-43-52(75-56)53-54(68-43)55(76-56)51-36(66-53)10-8-32(64-51)15-46(61)70-50-30(6)49-40(65-39(50)17-37(63-31)29(25)5)18-38-42(67-49)21-58(71-38)23-44-48(74-58)28(4)20-57(73-44)19-27(3)47-41(72-57)16-34(60)45(24-59)69-47/h25,27-28,30-45,47-55,60H,2,5,7-24,59H2,1,3-4,6H3/t25-,27+,28+,30+,31+,32-,33+,34-,35+,36+,37-,38-,39+,40+,41+,42-,43+,44+,45-,47+,48+,49+,50-,51+,52+,53+,54-,55+,56+,57-,58+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
E-7130
Code English
E7130
Preferred Name English
E 7130 [WHO-DD]
Common Name English
C52-HALICHONDRIN-B AMINE
Common Name English
Code System Code Type Description
FDA UNII
R6WE4X56YH
Created by admin on Wed Apr 02 11:35:14 GMT 2025 , Edited by admin on Wed Apr 02 11:35:14 GMT 2025
PRIMARY
NCI_THESAURUS
C156697
Created by admin on Wed Apr 02 11:35:14 GMT 2025 , Edited by admin on Wed Apr 02 11:35:14 GMT 2025
PRIMARY
PUBCHEM
155907622
Created by admin on Wed Apr 02 11:35:14 GMT 2025 , Edited by admin on Wed Apr 02 11:35:14 GMT 2025
PRIMARY