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Substance Name: Iturin C
RN: 52229-92-2
InChIKey: MVHYSGWFUVMTLO-UHFFFAOYSA-N

Molecular Weight

  • 1044.1667
 
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Names and Synonyms

Name of Substance

  • Iturin C

Systematic Name

  • Iturin C

Registry Numbers

CAS Registry Number

  • 52229-92-2

System Generated Number

  • 0052229922

Structure Descriptors

InChI

1S/C48H73N11O15/c1-2-3-4-5-6-7-8-9-10-12-28-22-40(65)53-34(25-41(66)67)45(71)55-31(21-27-14-16-29(61)17-15-27)42(68)56-32(23-38(50)63)43(69)54-30(18-19-37(49)62)48(74)59-20-11-13-36(59)47(73)57-33(24-39(51)64)44(70)58-35(26-60)46(72)52-28/h14-17,28,30-36,60-61H,2-13,18-26H2,1H3,(H2,49,62)(H2,50,63)(H2,51,64)(H,52,72)(H,53,65)(H,54,69)(H,55,71)(H,56,68)(H,57,73)(H,58,70)(H,66,67)

InChIKey

MVHYSGWFUVMTLO-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCC1CC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)NC(C(=O)N1)CO)CC(=O)N)CCC(=O)N)CC(=O)N)Cc3ccc(cc3)O)CC(=O)O