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Substance Name: Leptosin J
RN: 160550-15-2
InChIKey: XRTWKFIJLVVJBO-MPUJWKKJSA-N

Molecular Formula

  • C32-H32-N6-O7-S4

Molecular Weight

  • 740.9038
 
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Names and Synonyms

Results Name

  • Leptosin J

Synonyms

  • Leptosin J
  • Leptosine J

Systematic Names

  • 22bH-18,22a-(Iminomethano)-10b,23a-methano-10bH,23aH-indolo(2'',3'':2',3')(1,2,3,4,6)tetrathiazocino(6'',5'':1',5')pyrrolo(3',4':6,7)pyrazino(2''',1''':2,3)(1,3)oxazepino(4,5-b)indole-1,4,17,25(18H)-tetrone, 2,3,5a,6,15,15a-hexahydro-24-hydroxy-3-(hydroxymethyl)-2,26-dimethyl-18-(1-methylethyl)-, (3alpha,5aalpha,10bbeta,10cR*,15aalpha,18alpha,22aalpha,22bbeta,23abeta,24R*)-( )-
  • 22bH-18,22a-(Iminomethano)-10b,23a-methano-10bH,23aH-indolo(2'',3'':2',3')(1,2,3,4,6)tetrathiazocino(6'',5'':1',5')pyrrolo(3',4':6,7)pyrazino(2''',1''':2,3)(1,3)oxazepino(4,5-b)indole-1,4,17,25(18H)-tetrone, 2,3,5a,6,15,15a-hexahydro-24-hydroxy-3-(hydroxymethyl)-2,26-dimethyl-18-(1-methylethyl)-, (3R,5aR,10bS,10cR,15aS,18R,22aR,22bR,23aR,24R)-rel-( )-
  • Chaetocin, 2,5:2',5'-dide(epidithio)-19'-deoxy-2',5'-(epitetrathio)-5,6'-epoxy-6-hydroxy-19',19'-dimethyl-, (2alpha,5alpha,6S,6'S,15alpha)-

Registry Numbers

CAS Registry Number

  • 160550-15-2

System Generated Number

  • 0160550152

Structure Descriptors

InChI

1S/C32H32N6O7S4/c1-14(2)31-27(43)38-24-29(16-11-7-9-13-18(16)34-24)22(32(38,26(42)36(31)4)47-49-48-46-31)45-30-21(40)28(29)15-10-6-8-12-17(15)33-23(28)37(30)19(39)20(44-5)35(3)25(30)41/h6-14,20-24,33-34,40H,1-5H3/t20-,21-,22-,23-,24+,28?,29?,30-,31-,32-/m0/s1

InChIKey

XRTWKFIJLVVJBO-MPUJWKKJSA-N

Smiles

CO[C@@H]1N(C)C(=O)[C@]23O[C@@H]4[C@]56SSSS[C@](C(C)C)(N(C)C5=O)C(=O)N6[C@H]7Nc8ccccc8C47C9([C@@H](Nc%10ccccc9%10)N2C1=O)[C@@H]3O