(Q105302603)

English

N-[[(1R,2S,10R,12R,13R)-12-cyano-16,19-dihydroxy-7,18-dimethoxy-6,17,21-trimethyl-5,8,14-trioxo-11,21-diazapentacyclo[11.7.1.02,11.04,9.015,20]henicosa-4(9),6,15(20),16,18-pentaen-10-yl]methyl]-2-oxopropanamide

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

chemical compound

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mass

578.20127854 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₃₀N₄O₉

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canonical SMILES

N#CC1N2C(C=3C(=O)C(OC)=C(C(=O)C3CC2C4C=5C(O)=C(OC)C(=C(O)C5C(=O)C1N4C)C)C)CNC(=O)C(=O)C

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isomeric SMILES

COC1=C(C)C(=O)C2=C(C1=O)[C@H](CNC(=O)C(C)=O)N1[C@@H](C2)[C@H]2c3c(O)c(OC)c(C)c(O)c3C(=O)[C@@H]([C@@H]1C#N)N2C

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found in taxon

Streptomyces lavendulae

1 reference

stated in

Structural studies on minor components of saframycin group antibiotics saframycins F, G and H

Identifiers

InChI

InChI=1S/C29H30N4O9/c1-10-22(35)13-7-14-20-18-19(23(36)11(2)28(42-6)26(18)39)24(37)21(32(20)4)15(8-30)33(14)16(9-31-29(40)12(3)34)17(13)25(38)27(10)41-5/h14-16,20-21,36,39H,7,9H2,1-6H3,(H,31,40)/t14-,15-,16-,20-,21+/m0/s1

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InChIKey

WDQZQIAZHSHOFD-KUVPCWQVSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WDQZQIAZHSHOFD-KUVPCWQVSA-N

1 reference

(Q105302603)

N-[[(1R,2S,10R,12R,13R)-12-cyano-16,19-dihydroxy-7,18-dimethoxy-6,17,21-trimethyl-5,8,14-trioxo-11,21-diazapentacyclo[11.7.1.02,11.04,9.015,20]henicosa-4(9),6,15(20),16,18-pentaen-10-yl]methyl]-2-oxopropanamide

Statements

Identifiers

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