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Substance Name: Cycloheptamycin
RN: 30270-78-1
InChIKey: ASSZAURWVSBFSV-UHFFFAOYSA-N

Molecular Formula

  • C48-H68-N8-O12

Molecular Weight

  • 949.1092
 
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Names and Synonyms

Name of Substance

  • Cycloheptamycin

Systematic Name

  • Cycloheptamycin

Registry Numbers

CAS Registry Number

  • 30270-78-1

System Generated Number

  • 0030270781

Structure Descriptors

InChI

1S/C48H68N8O12/c1-12-26(5)41-45(62)54-40(37(58)13-2)47(64)55(8)36(21-30-23-49-34-19-18-32(67-11)22-33(30)34)48(65)68-28(7)39(53-43(60)38(25(3)4)50-24-57)44(61)52-35(20-29-14-16-31(66-10)17-15-29)42(59)51-27(6)46(63)56(41)9/h14-19,22-28,35-41,49,58H,12-13,20-21H2,1-11H3,(H,50,57)(H,51,59)(H,52,61)(H,53,60)(H,54,62)

InChIKey

ASSZAURWVSBFSV-UHFFFAOYSA-N

Smiles

CCC(C)C1C(=O)NC(C(=O)N(C(C(=O)OC(C(C(=O)NC(C(=O)NC(C(=O)N1C)C)Cc2ccc(cc2)OC)NC(=O)C(C(C)C)NC=O)C)Cc3c[nH]c4c3cc(cc4)OC)C)C(CC)O