(Q105214279)

English

(3S,6R,10S,13Z,16S)-10-[(3-chloro-4-methoxyphenyl)methyl]-6-methyl-3-(2-methylpropyl)-16-[(1R)-1-[(2R,3R)-3-phenyloxiran-2-yl]ethyl]-1,4-dioxa-8,11-diazacyclohexadec-13-ene-2,5,9,12-tetrone

chemical compound

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instance of

type of chemical entity

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subclass of

10-[(3-chloro-4-methoxyphenyl)methyl]-9,12-dihydroxy-6-methyl-3-(2-methylpropyl)-16-[1-(3-phenyloxiran-2-yl)ethyl]-1,4-dioxa-8,11-diazacyclohexadeca-8,11,13-triene-2,5-dione

1 reference

based on heuristic

inferred from SMILES

mass

654.270794016 dalton

1 reference

2 references

inferred from InChIKey

1 reference

1 reference

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1 reference

C₃₅H₄₃ClN₂O₈

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canonical SMILES

COc1ccc(CC2NC(=O)C=CCC(C(C)C3OC3c3ccccc3)OC(=O)C(CC(C)C)OC(=O)C(C)CNC2=O)cc1Cl

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isomeric SMILES

COc1ccc(C[C@@H]2NC(=O)/C=C\C[C@@H]([C@@H](C)[C@H]3O[C@@H]3c3ccccc3)OC(=O)[C@H](CC(C)C)OC(=O)[C@H](C)CNC2=O)cc1Cl

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found in taxon

Nostoc

10 references

stated in

Three new cryptophycins from Nostoc sp. GSV 224

stated in

Structure determination, conformational analysis, chemical stability studies, and antitumor evaluation of the cryptophycins. Isolation of 18 new analogs from Nostoc sp. strain GSV 224

stated in

Three new cryptophycins from Nostoc sp. GSV 224

stated in

Isolation and Structure Determination of Cryptophycins 38, 326, and 327 from the Terrestrial CyanobacteriumNostocsp. GSV 224†

stated in

Structure determination, conformational analysis, chemical stability studies, and antitumor evaluation of the cryptophycins. Isolation of 18 new analogs from Nostoc sp. strain GSV 224

stated in

Isolation and Structure Determination of Cryptophycins 38, 326, and 327 from the Terrestrial CyanobacteriumNostocsp. GSV 224†

stated in

Three new cryptophycins from Nostoc sp. GSV 224

stated in

Structure determination, conformational analysis, chemical stability studies, and antitumor evaluation of the cryptophycins. Isolation of 18 new analogs from Nostoc sp. strain GSV 224

stated in

Three new cryptophycins from Nostoc sp. GSV 224

stated in

Structure determination, conformational analysis, chemical stability studies, and antitumor evaluation of the cryptophycins. Isolation of 18 new analogs from Nostoc sp. strain GSV 224

Identifiers

InChI

InChI=1S/C35H43ClN2O8/c1-20(2)16-29-35(42)44-27(22(4)31-32(46-31)24-10-7-6-8-11-24)12-9-13-30(39)38-26(33(40)37-19-21(3)34(41)45-29)18-23-14-15-28(43-5)25(36)17-23/h6-11,13-15,17,20-22,26-27,29,31-32H,12,16,18-19H2,1-5H3,(H,37,40)(H,38,39)/b13-9-/t21-,22-,26+,27+,29+,31-,32-/m1/s1

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InChIKey

PSNOPSMXOBPNNV-HHZXTMCASA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PSNOPSMXOBPNNV-HHZXTMCASA-N

1 reference

(Q105214279)

(3S,6R,10S,13Z,16S)-10-[(3-chloro-4-methoxyphenyl)methyl]-6-methyl-3-(2-methylpropyl)-16-[(1R)-1-[(2R,3R)-3-phenyloxiran-2-yl]ethyl]-1,4-dioxa-8,11-diazacyclohexadec-13-ene-2,5,9,12-tetrone

Statements

Identifiers

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