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Details

Stereochemistry ABSOLUTE
Molecular Formula C34H32N8O7S
Molecular Weight 696.732
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of YM-216391

SMILES

[H][C@]1(NC(=O)C2=C(OC(=N2)C3=CSC(=N3)C4=COC(=N4)C5=COC(=N5)C6=COC(CNC(=O)[C@H](NC1=O)C(C)C)=N6)C7=CC=CC=C7)[C@@H](C)CC

InChI

InChIKey=TXKVZUHICTYULO-AJHZIAPWSA-N
InChI=1S/C34H32N8O7S/c1-5-17(4)25-29(44)40-24(16(2)3)28(43)35-11-23-36-19(12-46-23)31-37-20(13-47-31)32-38-21(14-48-32)34-39-22(15-50-34)33-42-26(30(45)41-25)27(49-33)18-9-7-6-8-10-18/h6-10,12-17,24-25H,5,11H2,1-4H3,(H,35,43)(H,40,44)(H,41,45)/t17-,24+,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula C34H32N8O7S
Molecular Weight 696.732
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:57:59 GMT 2023
Edited
by admin
on Sat Dec 16 14:57:59 GMT 2023
Record UNII
I0ZXM82ED1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
YM-216391
Code English
3,7,15,28-TETRAOXA-11-THIA-19,22,25,30,31,32,33,34-OCTAAZAHEXACYCLO(25.2.1.12,5.16,9.110,13.114,17)TETRATRIACONTA-2(34),4,6(33),8,10(32),12,14(31),16,27(30),29-DECAENE-18,21,24-TRIONE, 23-(1-METHYLETHYL)-20-((1S)-1-METHYLPROPYL)-16-PHENYL-, (20S,23R)-
Systematic Name English
Code System Code Type Description
CAS
230645-58-6
Created by admin on Sat Dec 16 14:57:59 GMT 2023 , Edited by admin on Sat Dec 16 14:57:59 GMT 2023
PRIMARY
FDA UNII
I0ZXM82ED1
Created by admin on Sat Dec 16 14:57:59 GMT 2023 , Edited by admin on Sat Dec 16 14:57:59 GMT 2023
PRIMARY
PUBCHEM
11296976
Created by admin on Sat Dec 16 14:57:59 GMT 2023 , Edited by admin on Sat Dec 16 14:57:59 GMT 2023
PRIMARY