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

Details

Stereochemistry ABSOLUTE
Molecular Formula C60H109N3O27
Molecular Weight 1304.5114
Optical Activity UNSPECIFIED
Defined Stereocenters 15 / 15
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of UPROLESELAN

SMILES

CC[C@H]1C[C@H](C[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@@H](CC3CCCCC3)C(O)=O)[C@H]2NC(C)=O)[C@@H]1O[C@@H]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]4O)C(=O)NCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC

InChI

InChIKey=LYSYOXNOOPBOSC-NGSKMYNLSA-N
InChI=1S/C60H109N3O27/c1-5-44-38-45(39-46(55(44)90-60-54(70)53(69)51(67)41(2)86-60)88-59-50(63-42(3)65)56(52(68)48(40-64)89-59)87-47(58(72)73)37-43-9-7-6-8-10-43)57(71)62-13-12-61-49(66)11-14-75-17-18-77-21-22-79-25-26-81-29-30-83-33-34-85-36-35-84-32-31-82-28-27-80-24-23-78-20-19-76-16-15-74-4/h41,43-48,50-56,59-60,64,67-70H,5-40H2,1-4H3,(H,61,66)(H,62,71)(H,63,65)(H,72,73)/t41-,44-,45+,46+,47-,48+,50+,51+,52-,53+,54-,55+,56+,59+,60-/m0/s1

HIDE SMILES / InChI

Molecular Formula C60H109N3O27
Molecular Weight 1304.5114
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 15 / 15
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:51:26 GMT 2023
Edited
by admin
on Sat Dec 16 09:51:26 GMT 2023
Record UNII
PE952ANF83
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
UPROLESELAN
USAN   INN  
Official Name English
uproleselan [INN]
Common Name English
Uproleselan [WHO-DD]
Common Name English
GMI-1271 FREE ACID
Code English
UPROLESELAN [USAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29750
Created by admin on Sat Dec 16 09:51:27 GMT 2023 , Edited by admin on Sat Dec 16 09:51:27 GMT 2023
NCI_THESAURUS C274
Created by admin on Sat Dec 16 09:51:27 GMT 2023 , Edited by admin on Sat Dec 16 09:51:27 GMT 2023
Code System Code Type Description
PUBCHEM
71600085
Created by admin on Sat Dec 16 09:51:27 GMT 2023 , Edited by admin on Sat Dec 16 09:51:27 GMT 2023
PRIMARY
INN
10774
Created by admin on Sat Dec 16 09:51:27 GMT 2023 , Edited by admin on Sat Dec 16 09:51:27 GMT 2023
PRIMARY
DRUG BANK
DB14829
Created by admin on Sat Dec 16 09:51:27 GMT 2023 , Edited by admin on Sat Dec 16 09:51:27 GMT 2023
PRIMARY
NCI_THESAURUS
C119743
Created by admin on Sat Dec 16 09:51:27 GMT 2023 , Edited by admin on Sat Dec 16 09:51:27 GMT 2023
PRIMARY
CAS
1983970-12-2
Created by admin on Sat Dec 16 09:51:27 GMT 2023 , Edited by admin on Sat Dec 16 09:51:27 GMT 2023
PRIMARY
FDA UNII
PE952ANF83
Created by admin on Sat Dec 16 09:51:27 GMT 2023 , Edited by admin on Sat Dec 16 09:51:27 GMT 2023
PRIMARY
USAN
EF-61
Created by admin on Sat Dec 16 09:51:27 GMT 2023 , Edited by admin on Sat Dec 16 09:51:27 GMT 2023
PRIMARY
SMS_ID
100000181196
Created by admin on Sat Dec 16 09:51:27 GMT 2023 , Edited by admin on Sat Dec 16 09:51:27 GMT 2023
PRIMARY
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SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY