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Substance Name: Trichofumin A
RN: 668418-99-3
InChIKey: CTJPTXSEKZSXIR-HVSFNPNRSA-N

Molecular Formula

  • C59-H104-N12-O13

Molecular Weight

  • 1189.5416
 
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Names and Synonyms

Results Name

  • Trichofumin A

Synonym

  • Trichofumin A

Systematic Name

  • L-Prolinamide, N-acetyl-L-valyl-L-glutaminyl-L-leucyl-L-valyl-2-methylalanyl-L-prolyl-L-leucyl-L-leucyl-2-methylalanyl-N-((1S)-1-(hydroxymethyl)-3-methylbutyl)-

Registry Numbers

CAS Registry Number

  • 668418-99-3

System Generated Number

  • 0668418993

Structure Descriptors

InChI

1S/C59H104N12O13/c1-31(2)26-38(30-72)62-52(79)43-20-18-24-70(43)56(83)58(14,15)68-51(78)42(29-34(7)8)65-49(76)40(27-32(3)4)66-53(80)44-21-19-25-71(44)57(84)59(16,17)69-55(82)47(36(11)12)67-50(77)41(28-33(5)6)64-48(75)39(22-23-45(60)74)63-54(81)46(35(9)10)61-37(13)73/h31-36,38-44,46-47,72H,18-30H2,1-17H3,(H2,60,74)(H,61,73)(H,62,79)(H,63,81)(H,64,75)(H,65,76)(H,66,80)(H,67,77)(H,68,78)(H,69,82)/t38-,39+,40+,41+,42+,43+,44+,46+,47+/m1/s1

InChIKey

CTJPTXSEKZSXIR-HVSFNPNRSA-N

Smiles

CC(C)C[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]2CCCN2C(=O)C(C)(C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H](NC(=O)C)C(C)C)C(C)C