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Substance Name: Actinoidins
RN: 39319-82-9
InChIKey: FHIABUHDBXFQIT-JSNQUVIDSA-N

Note

  • Belongs to vancomycin antibiotic group.

Molecular Formula

  • Unspecified

Molecular Weight

  • 1761.1516
 
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Names and Synonyms

Name of Substance

  • Actinoidins

Synonym

  • Actinoidin

Systematic Name

  • Actinoidin

Registry Numbers

CAS Registry Number

  • 39319-82-9

System Generated Number

  • 0039319829

Structure Descriptors

InChI

1S/C84H94ClN9O31/c1-32-65(100)46(86)28-56(116-32)124-75-70(105)68(103)55(31-96)122-84(75)125-74-52-24-39-25-53(74)119-50-20-14-38(23-45(50)85)73(123-57-29-47(87)72(115-3)33(2)117-57)64-81(112)92-62(82(113)114)44-26-41(98)27-51(120-83-71(106)69(104)67(102)54(30-95)121-83)58(44)43-22-37(13-19-49(43)99)60(78(109)94-64)91-79(110)61(39)90-76(107)48(21-34-7-5-4-6-8-34)89-80(111)63(66(101)36-11-17-42(118-52)18-12-36)93-77(108)59(88)35-9-15-40(97)16-10-35/h4-20,22-27,32-33,46-48,54-57,59-73,75,83-84,95-106H,21,28-31,86-88H2,1-3H3,(H,89,111)(H,90,107)(H,91,110)(H,92,112)(H,93,108)(H,94,109)(H,113,114)/t32-,33-,46-,47-,48?,54+,55+,56-,57-,59?,60?,61?,62?,63?,64?,65-,66?,67+,68+,69-,70-,71-,72-,73?,75+,83-,84-/m0/s1

InChIKey

FHIABUHDBXFQIT-JSNQUVIDSA-N

Smiles

C[C@H]1[C@@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2Oc3c4cc5cc3Oc6ccc(cc6Cl)C(C7C(=O)NC(c8cc(cc(c8-c9cc(ccc9O)C(C(=O)N7)NC(=O)C5NC(=O)C(NC(=O)C(C(c1ccc(cc1)O4)O)NC(=O)C(c1ccc(cc1)O)N)Cc1ccccc1)O[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)C(=O)O)O[C@H]1C[C@@H]([C@H]([C@@H](O1)C)OC)N)CO)O)O)N)O