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Substance Name: Himastatin
RN: 126775-74-4
InChIKey: OZPNLJQULOIOGU-IEGPOQBUSA-N

Note

  • Isolated from cultured broth of Streptomyces hygroscopious.

Molecular Formulas

  • C72-H104-N14-O20
  • Unspecified

Molecular Weight

  • 1485.6916
 
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Names and Synonyms

Name of Substance

  • Himastatin

Systematic Name

  • Antibiotic bmy 40800

Registry Numbers

CAS Registry Number

  • 126775-74-4

System Generated Number

  • 0126775744

Structure Descriptors

InChI

1S/C72H104N14O20/c1-29(2)19-45-57(91)81-53(35(13)87)63(97)83-49(61(95)79-51(31(5)6)67(101)105-55(33(9)10)65(99)85-47(59(93)75-45)23-39(89)27-73-85)25-71(103)41-21-37(15-17-43(41)77-69(71)83)38-16-18-44-42(22-38)72(104)26-50-62(96)80-52(32(7)8)68(102)106-56(34(11)12)66(100)86-48(24-40(90)28-74-86)60(94)76-46(20-30(3)4)58(92)82-54(36(14)88)64(98)84(50)70(72)78-44/h15-18,21-22,29-36,39-40,45-56,69-70,73-74,77-78,87-90,103-104H,19-20,23-28H2,1-14H3,(H,75,93)(H,76,94)(H,79,95)(H,80,96)(H,81,91)(H,82,92)/t35-,36-,39+,40+,45-,46-,47?,48?,49+,50?,51+,52+,53+,54?,55-,56-,69?,70?,71+,72+/m0/s1

InChIKey

OZPNLJQULOIOGU-IEGPOQBUSA-N

Smiles

C[C@@H]([C@@H]1C(=O)N2[C@H](C[C@@]3(C2Nc4c3cc(cc4)c5ccc6c(c5)[C@@]7(CC8C(=O)N[C@@H](C(=O)O[C@H](C(=O)N9C(C[C@H](CN9)O)C(=O)N[C@H](C(=O)NC(C(=O)N8C7N6)[C@H](C)O)CC(C)C)C(C)C)C(C)C)O)O)C(=O)N[C@@H](C(=O)O[C@H](C(=O)N2C(C[C@H](CN2)O)C(=O)N[C@H](C(=O)N1)CC(C)C)C(C)C)C(C)C)O