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

Details

Stereochemistry ABSOLUTE
Molecular Formula C92H175N2O17P.C6H15N
Molecular Weight 1713.5409
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RIBI-529

SMILES

CCN(CC)CC.CCCCCCCCCCCCCC(=O)O[C@H](CCCCCCCCCCC)CC(=O)NCCO[C@@H]1O[C@H](CO)[C@@H](OP(O)(O)=O)[C@H](OC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC)[C@H]1NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC

InChI

InChIKey=QOFRNSMLZCPQKL-KTIIIUPTSA-N
InChI=1S/C92H175N2O17P.C6H15N/c1-7-13-19-25-31-37-40-46-52-58-64-70-85(98)106-79(67-61-55-49-43-34-28-22-16-10-4)75-83(96)93-73-74-105-92-89(94-84(97)76-80(68-62-56-50-44-35-29-23-17-11-5)107-86(99)71-65-59-53-47-41-38-32-26-20-14-8-2)91(90(82(78-95)109-92)111-112(102,103)104)110-88(101)77-81(69-63-57-51-45-36-30-24-18-12-6)108-87(100)72-66-60-54-48-42-39-33-27-21-15-9-3;1-4-7(5-2)6-3/h79-82,89-92,95H,7-78H2,1-6H3,(H,93,96)(H,94,97)(H2,102,103,104);4-6H2,1-3H3/t79-,80-,81-,82-,89-,90-,91-,92-;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
RIBI-529
Common Name English
RC-529E
Code English
RC-529AF
Code English
CDX-2101
Code English
RC-529
Code English
RC-529SE
Code English
Code System Code Type Description
FDA UNII
FQR7P879JZ
Created by admin on Sat Dec 16 11:07:22 GMT 2023 , Edited by admin on Sat Dec 16 11:07:22 GMT 2023
PRIMARY
CAS
216014-46-9
Created by admin on Sat Dec 16 11:07:22 GMT 2023 , Edited by admin on Sat Dec 16 11:07:22 GMT 2023
PRIMARY
PUBCHEM
9964020
Created by admin on Sat Dec 16 11:07:22 GMT 2023 , Edited by admin on Sat Dec 16 11:07:22 GMT 2023
PRIMARY