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Substance Name: Arthrofactin
RN: 152406-36-5
InChIKey: HXMCERBOSXQYRH-PUWFPHIESA-N

Note

  • A lipopeptide biosurfactant.

Molecular Weight

  • 1354.6379
 
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Names and Synonyms

Name of Substance

  • Arthrofactin

Systematic Name

  • L-Aspartic acid, N-(N-(N-(N-(N-(N-(N-(N-(N-(N-(N-(3-hydroxy-1-oxodecyl)-D-leucyl)-D-alpha-aspartyl)-D-threonyl)-D-leucyl)-D-leucyl)-D-seryl)-L-leucyl)-D-seryl)-L-isoleucyl)-L-isoleucyl)-, lambda1-lactone

Registry Numbers

CAS Registry Number

  • 152406-36-5

System Generated Number

  • 0152406365

Structure Descriptors

InChI

1S/C64H111N11O20/c1-15-18-19-20-21-22-39-27-48(79)65-40(23-32(4)5)54(84)68-44(28-49(80)81)58(88)75-53(38(14)78)63(93)69-43(26-35(10)11)55(85)66-41(24-33(6)7)56(86)71-46(30-76)59(89)67-42(25-34(8)9)57(87)72-47(31-77)60(90)73-52(37(13)17-3)62(92)74-51(36(12)16-2)61(91)70-45(29-50(82)83)64(94)95-39/h32-47,51-53,76-78H,15-31H2,1-14H3,(H,65,79)(H,66,85)(H,67,89)(H,68,84)(H,69,93)(H,70,91)(H,71,86)(H,72,87)(H,73,90)(H,74,92)(H,75,88)(H,80,81)(H,82,83)/t36-,37-,38-,39?,40+,41+,42-,43+,44+,45-,46+,47+,51-,52-,53?/m0/s1

InChIKey

HXMCERBOSXQYRH-PUWFPHIESA-N

Smiles

CCCCCCCC1CC(=O)N[C@@H](C(=O)N[C@@H](C(=O)NC(C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O1)CC(=O)O)[C@@H](C)CC)[C@@H](C)CC)CO)CC(C)C)CO)CC(C)C)CC(C)C)[C@H](C)O)CC(=O)O)CC(C)C