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Substance Name: JMV-1645
RN: 284037-77-0
UNII: 8PY38JSG1Y
InChIKey: DSKXSKYPLRUWNI-QSFUMIHFSA-N

Molecular Formula

  • C49-H69-N13-O12-S

Molecular Weight

  • 1064.2291
 
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Names and Synonyms

Name of Substance

  • JMV-1645

Synonyms

  • JMV-1645
  • L-Serinamide, L-lysyl-L-arginyl-L-prolyl-(4R)-4-hydroxy-L-prolylglycyl-(2S)-2-(2,3-dihydro-1H-inden-2-yl)glycyl-N-((3S)-5-(carboxymethyl)-2,3,4,5-tetrahydro-4-oxo-1,5-benzothiazepin-3-yl)-
  • UNII-8PY38JSG1Y

Registry Numbers

CAS Registry Number

  • 284037-77-0

FDA UNII

  • 8PY38JSG1Y

System Generated Number

  • 0284037770

Structure Descriptors

InChI

1S/C49H69N13O12S/c50-16-6-5-11-31(51)42(68)56-32(12-7-17-54-49(52)53)46(72)60-18-8-14-36(60)48(74)61-23-30(64)21-37(61)44(70)55-22-39(65)59-41(29-19-27-9-1-2-10-28(27)20-29)45(71)57-33(25-63)43(69)58-34-26-75-38-15-4-3-13-35(38)62(47(34)73)24-40(66)67/h1-4,9-10,13,15,29-34,36-37,41,63-64H,5-8,11-12,14,16-26,50-51H2,(H,55,70)(H,56,68)(H,57,71)(H,58,69)(H,59,65)(H,66,67)(H4,52,53,54)/t30-,31+,32+,33+,34-,36+,37+,41+/m1/s1

InChIKey

DSKXSKYPLRUWNI-QSFUMIHFSA-N

Smiles

c1ccc2c(c1)CC(C2)[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H]3CSc4ccccc4N(C3=O)CC(=O)O)NC(=O)CNC(=O)[C@@H]5C[C@H](CN5C(=O)[C@@H]6CCCN6C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)N)O