(4S,7R,8S,11R,18S,22S,25R)-7-Methyl-11,25-bis(1-methylethyl)-4,18-bis[(1S)-1-methylpropyl]-6,20-dioxa-13,27-dithia-3,10,17,24,29,30,31,32-octaazapentacyclo[24.2.1.15,8.112,15.119,22]dotriaconta-5(32),12(31),14,19(30),26(29),28-hexaene-2,9,16,23-tetrone

CAS Registry Number®

81120-73-2
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CAS Name

(4S,7R,8S,11R,18S,22S,25R)-7-Methyl-11,25-bis(1-methylethyl)-4,18-bis[(1S)-1-methylpropyl]-6,20-dioxa-13,27-dithia-3,10,17,24,29,30,31,32-octaazapentacyclo[24.2.1.15,8.112,15.119,22]dotriaconta-5(32),12(31),14,19(30),26(29),28-hexaene-2,9,16,23-tetrone

Molecular Formula

C35H50N8O6S2

Molecular Mass

742.95

Cite this Page

(4S,7R,8S,11R,18S,22S,25R)-7-Methyl-11,25-bis(1-methylethyl)-4,18-bis[(1S)-1-methylpropyl]-6,20-dioxa-13,27-dithia-3,10,17,24,29,30,31,32-octaazapentacyclo[24.2.1.15,8.112,15.119,22]dotriaconta-5(32),12(31),14,19(30),26(29),28-hexaene-2,9,16,23-tetrone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=81120-73-2 (retrieved 2024-04-20) (CAS RN: 81120-73-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C35H50N8O6S2/c1-10-17(7)25-32-36-20(12-48-32)28(44)39-23(15(3)4)34-37-22(14-50-34)30(46)42-26(18(8)11-2)33-43-27(19(9)49-33)31(47)40-24(16(5)6)35-38-21(13-51-35)29(45)41-25/h13-20,23-27H,10-12H2,1-9H3,(H,39,44)(H,40,47)(H,41,45)(H,42,46)/t17-,18-,19+,20-,23+,24+,25-,26-,27-/m0/s1

InChIKey

InChIKey=ZGJIVWQOEHQWLW-SWTUTNCKSA-N

SMILES

[C@@H](CC)(C)[C@]1(C2=N[C@@]([C@@H](C)O2)(C(=O)N[C@H]([C@@H](C)C)C3=NC(=CS3)C(=O)N[C@@]([C@H](CC)C)(C4=N[C@](C(=O)N[C@H]([C@@H](C)C)C5=NC(C(=O)N1)=CS5)(CO4)[H])[H])[H])[H]

Canonical SMILES

O=C1NC(C2=NC(C(=O)NC(C3=NC(=CS3)C(=O)NC(C4=NC(C(=O)NC(C5=NC1=CS5)C(C)C)C(O4)C)C(C)CC)C(C)C)CO2)C(C)CC

Other Names for this Substance

  • 6,20-Dioxa-13,27-dithia-3,10,17,24,29,30,31,32-octaazapentacyclo[24.2.1.15,8.112,15.119,22]dotriaconta-5(32),12(31),14,19(30),26(29),28-hexaene-2,9,16,23-tetrone, 7-methyl-11,25-bis(1-methylethyl)-4,18-bis[(1S)-1-methylpropyl]-, (4S,7R,8S,11R,18S,22S,25R)-
  • 6,20-Dioxa-13,27-dithia-3,10,17,24,29,30,31,32-octaazapentacyclo[24.2.1.15,8.112,15.119,22]dotriaconta-5(32),12(31),14,19(30),26(29),28-hexaene-2,9,16,23-tetrone, 7-methyl-11,25-bis(1-methylethyl)-4,18-bis(1-methylpropyl)-, [4S-[4R*(R*),7S*,8R*,11S*,18R*(R*),22R*,25S*]]-
  • Ulithiacyclamide, 1,15-de[dithiobis(methylene)]-4-demethyl-8,22-dide(2-methylpropyl)-8,22-bis(1-methylethyl)-1,15-bis(1-methylpropyl)-, [1S(S),8R,15S(S),22R]-
  • (4S,7R,8S,11R,18S,22S,25R)-7-Methyl-11,25-bis(1-methylethyl)-4,18-bis[(1S)-1-methylpropyl]-6,20-dioxa-13,27-dithia-3,10,17,24,29,30,31,32-octaazapentacyclo[24.2.1.15,8.112,15.119,22]dotriaconta-5(32),12(31),14,19(30),26(29),28-hexaene-2,9,16,23-tetrone
  • Patellamide A

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