(Q105132534)

English

(2R)-2-amino-3-[[(4R,7E,9R,10R,11R,12R)-12-[(Z,4R,7S)-8-(2,6-dioxopiperidin-4-yl)-7-hydroxy-4-methyl-5-oxooct-2-en-2-yl]-10-hydroxy-9-methoxy-11-methyl-2-oxo-1-oxacyclododec-7-en-4-yl]sulfanyl]propanoic acid

No description defined

In more languages

default for all languages

No label defined

No description defined

edit

Statements

instance of

type of chemical entity

0 references

subclass of

2-amino-3-[[(7Z)-12-[(E)-8-(2,6-dioxopiperidin-4-yl)-7-hydroxy-4-methyl-5-oxooct-2-en-2-yl]-10-hydroxy-9-methoxy-11-methyl-2-oxo-1-oxacyclododec-7-en-4-yl]sulfanyl]propanoic acid

1 reference

based on heuristic

inferred from SMILES

2-Amino-3-[[12-[8-(2,6-dioxopiperidin-4-yl)-7-hydroxy-4-methyl-5-oxooct-2-en-2-yl]-10-hydroxy-9-methoxy-11-methyl-2-oxo-1-oxacyclododec-7-en-4-yl]sulfanyl]propanoic acid

1 reference

based on heuristic

inferred from SMILES

mass

626.287316672 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₄₆N₂O₁₀S

0 references

canonical SMILES

COC1C=CCCC(SCC(N)C(=O)O)CC(=O)OC(C(C)=CC(C)C(=O)CC(O)CC2CC(=O)NC(=O)C2)C(C)C1O

0 references

isomeric SMILES

CO[C@@H]1/C=C/CC[C@@H](SC[C@H](N)C(=O)O)CC(=O)O[C@@H](/C(C)=C\[C@@H](C)C(=O)C[C@@H](O)CC2CC(=O)NC(=O)C2)[C@H](C)[C@H]1O

0 references

found in taxon

Streptomyces

1 reference

stated in

NK30424A and B, novel inhibitors of lipopolysaccharide-induced tumour necrosis factor alpha production, produced by Streptomyces sp. NA30424

Identifiers

InChI

InChI=1S/C30H46N2O10S/c1-16(23(34)13-20(33)10-19-11-25(35)32-26(36)12-19)9-17(2)29-18(3)28(38)24(41-4)8-6-5-7-21(14-27(37)42-29)43-15-22(31)30(39)40/h6,8-9,16,18-22,24,28-29,33,38H,5,7,10-15,31H2,1-4H3,(H,39,40)(H,32,35,36)/b8-6+,17-9-/t16-,18-,20+,21-,22+,24-,28-,29+/m1/s1

0 references

InChIKey

JOTZTCRQORWZKM-OCQJMBSSSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JOTZTCRQORWZKM-OCQJMBSSSA-N

(Q105132534)

(2R)-2-amino-3-[[(4R,7E,9R,10R,11R,12R)-12-[(Z,4R,7S)-8-(2,6-dioxopiperidin-4-yl)-7-hydroxy-4-methyl-5-oxooct-2-en-2-yl]-10-hydroxy-9-methoxy-11-methyl-2-oxo-1-oxacyclododec-7-en-4-yl]sulfanyl]propanoic acid

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)