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Details

Stereochemistry ABSOLUTE
Molecular Formula C46H83N13O11
Molecular Weight 994.2317
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ABT-510

SMILES

CCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CN(C)C(C)=O)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC

InChI

InChIKey=RIWLPSIAFBLILR-WVNGMBSFSA-N
InChI=1S/C46H83N13O11/c1-12-18-30(39(64)55-36(26(7)13-2)42(67)53-31(19-16-21-50-46(47)48)45(70)59-22-17-20-32(59)40(65)49-15-4)52-44(69)38(28(9)60)57-43(68)37(27(8)14-3)56-41(66)35(25(5)6)54-33(62)23-51-34(63)24-58(11)29(10)61/h25-28,30-32,35-38,60H,12-24H2,1-11H3,(H,49,65)(H,51,63)(H,52,69)(H,53,67)(H,54,62)(H,55,64)(H,56,66)(H,57,68)(H4,47,48,50)/t26-,27-,28+,30-,31-,32-,35-,36-,37+,38-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ABT-510
Common Name English
Abt 510 [WHO-DD]
Common Name English
L-PROLINAMIDE, N-ACETYL-N-METHYLGLYCYLGLYCYL-L-VALYL-D-ALLOISOLEUCYL-L-THREONYL-L-NORVALYL-L-ISOLEUCYL-L-ARGINYL-N-ETHYL-
Common Name English
ABT 510
WHO-DD  
Code English
Classification Tree Code System Code
NCI_THESAURUS C1971
Created by admin on Fri Dec 15 18:50:51 UTC 2023 , Edited by admin on Fri Dec 15 18:50:51 UTC 2023
Code System Code Type Description
CAS
251579-55-2
Created by admin on Fri Dec 15 18:50:51 UTC 2023 , Edited by admin on Fri Dec 15 18:50:51 UTC 2023
PRIMARY
PUBCHEM
6918562
Created by admin on Fri Dec 15 18:50:51 UTC 2023 , Edited by admin on Fri Dec 15 18:50:51 UTC 2023
PRIMARY
EPA CompTox
DTXSID80870283
Created by admin on Fri Dec 15 18:50:51 UTC 2023 , Edited by admin on Fri Dec 15 18:50:51 UTC 2023
PRIMARY
FDA UNII
CRR8E37XOB
Created by admin on Fri Dec 15 18:50:51 UTC 2023 , Edited by admin on Fri Dec 15 18:50:51 UTC 2023
PRIMARY
DRUG BANK
DB05434
Created by admin on Fri Dec 15 18:50:51 UTC 2023 , Edited by admin on Fri Dec 15 18:50:51 UTC 2023
PRIMARY
NCI_THESAURUS
C37447
Created by admin on Fri Dec 15 18:50:51 UTC 2023 , Edited by admin on Fri Dec 15 18:50:51 UTC 2023
PRIMARY