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Substance Name: Iprocinodine II
RN: 60830-80-0
UNII: AA358NU48T
InChIKey: FJPCGBFVXKBORY-QTRGFMEWSA-N

Molecular Formula

  • C40-H65-N13-O13

Molecular Weight

  • 936.0315
 
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Names and Synonyms

Name of Substance

  • Iprocinodine II

Synonyms

  • Antibiotic BM-123gamma2, 1-(1-methylethyl)-
  • Iprocinodine II
  • UNII-AA358NU48T

Registry Numbers

CAS Registry Number

  • 60830-80-0

FDA UNII

  • AA358NU48T

System Generated Number

  • 0060830800

Structure Descriptors

InChI

1S/C40H65N13O13/c1-19(2)46-15-5-4-13-45-14-6-16-47-25(54)12-9-21-7-10-22(11-8-21)64-35-30(48-36(41)42)32(56)26(20(3)63-35)51-39(59)53-33-29(50-38(44)58)31(55)24(18-61-33)65-34-28(49-37(43)57)27-23(17-62-34)66-40(60)52-27/h7-12,19-20,23-24,26-35,45-46,55-56H,4-6,13-18H2,1-3H3,(H,47,54)(H,52,60)(H4,41,42,48)(H3,43,49,57)(H3,44,50,58)(H2,51,53,59)/b12-9+/t20-,23-,24-,26-,27+,28-,29-,30-,31+,32+,33+,34+,35-/m1/s1

InChIKey

FJPCGBFVXKBORY-QTRGFMEWSA-N

Smiles

C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)Oc2ccc(cc2)/C=C/C(=O)NCCCNCCCCNC(C)C)NC(=N)N)O)NC(=O)N[C@@H]3[C@@H]([C@H]([C@@H](CO3)O[C@H]4[C@@H]([C@@H]5[C@@H](CO4)OC(=O)N5)NC(=O)N)O)NC(=O)N