(Q104993537)

English

19-Methyl-12-(2-methylpropyl)-22-propan-2-yl-33-oxa-4,17-dithia-10,13,20,23,29,34,35,36-octazahexacyclo[29.2.1.12,5.115,18.06,10.025,29]hexatriaconta-1(34),2,5(36),15,18(35),31-hexaene-11,14,21,24,30-pentone

group of stereoisomers with the chemical formula C₃₃H₄₂N₈O₆S₂

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Statements

instance of

group of stereoisomers

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1 reference

biogenic cyclopeptide

1 reference

inferred from

biogenic cyclopeptide

mass

710.2668730640005 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₃H₄₂N₈O₆S₂

0 references

canonical SMILES

CC(C)CC1NC(=O)c2csc(n2)C(C)NC(=O)C(C(C)C)NC(=O)C2CCCN2C(=O)c2coc(n2)-c2csc(n2)C2CCCN2C1=O

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Identifiers

InChI

InChI=1S/C33H42N8O6S2/c1-16(2)12-19-32(45)41-11-7-9-24(41)31-38-22(15-49-31)29-36-20(13-47-29)33(46)40-10-6-8-23(40)27(43)39-25(17(3)4)28(44)34-18(5)30-37-21(14-48-30)26(42)35-19/h13-19,23-25H,6-12H2,1-5H3,(H,34,44)(H,35,42)(H,39,43)

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InChIKey

FDDMSTZRSIHETC-UHFFFAOYSA-N

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PubChem CID

74834310

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

FDDMSTZRSIHETC-UHFFFAOYSA-N

(Q104993537)

19-Methyl-12-(2-methylpropyl)-22-propan-2-yl-33-oxa-4,17-dithia-10,13,20,23,29,34,35,36-octazahexacyclo[29.2.1.12,5.115,18.06,10.025,29]hexatriaconta-1(34),2,5(36),15,18(35),31-hexaene-11,14,21,24,30-pentone

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