(Q105267173)

English

11,25-diisopropyl-4-methyl-8,22-bis(sec-butyl)-3,17-dioxa-13,27-dithia-7,10,21,24,29,30,31,32-octaazapentacyclo[24.2.1.1²,⁵.1¹²,¹⁵.1¹⁶,¹⁹]dotriaconta-1(28),2(32),6,9,12(31),14,16(30),20,23,26(29)-decaene-6,9,20,23-tetrol

group of stereoisomers with the chemical formula C₃₅H₅₀N₈O₆S₂

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instance of

group of stereoisomers

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1 reference

biogenic cyclopeptide

1 reference

inferred from

biogenic cyclopeptide

mass

742.3294733200004 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₅H₅₀N₈O₆S₂

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canonical SMILES

CCC(C)C1NC(=O)C2COC(=N2)c2csc(n2)C(C(C)C)NC(=O)C(C(C)CC)NC(=O)C2N=C(OC2C)c2csc(n2)C(C(C)C)NC1=O

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Identifiers

InChI

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

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InChIKey

TXYYEFNIVWFRLF-UHFFFAOYSA-N

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PubChem CID

14308095

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

TXYYEFNIVWFRLF-UHFFFAOYSA-N

(Q105267173)

11,25-diisopropyl-4-methyl-8,22-bis(sec-butyl)-3,17-dioxa-13,27-dithia-7,10,21,24,29,30,31,32-octaazapentacyclo[24.2.1.1²,⁵.1¹²,¹⁵.1¹⁶,¹⁹]dotriaconta-1(28),2(32),6,9,12(31),14,16(30),20,23,26(29)-decaene-6,9,20,23-tetrol

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