(Q105137181)

English

citrulassin A

chemical compound

In more languages

default values for all languages

No label defined

No description defined

Statements

type of chemical entity

0 references

biogenic cyclopeptide

0 references

1,564.89369086 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₆₉H₁₂₀N₂₀O₂₁

0 references

canonical SMILES

CC(C)CC1NC(=O)CNC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)CC(C(=O)NC(CCCNC(N)=O)C(=O)NC(CC(C)C)C(=O)NC(C(=O)NC(CC(C)C)C(=O)NC(CO)C(=O)NC(CCCCN)C(=O)NC(CC(N)=O)C(=O)O)C(C)C)NC(=O)C(CC(N)=O)NC(=O)CNC(=O)C(C)NC1=O

0 references

isomeric SMILES

CC(C)C[C@@H]1NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@@H](C(=O)N[C@@H](CCCNC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](C)NC1=O

0 references

Streptomyces albulus

1 reference

A new genome-mining tool redefines the lasso peptide biosynthetic landscape.

Identifiers

InChI=1S/C69H120N20O21/c1-32(2)21-41-57(97)76-30-54(95)79-42(22-33(3)4)60(100)77-38(13)56(96)75-29-53(94)80-46(26-50(71)91)63(103)85-47(28-52(93)78-43(23-34(5)6)61(101)83-41)64(104)81-40(18-16-20-74-69(73)110)58(98)84-45(25-36(9)10)65(105)89-55(37(11)12)67(107)86-44(24-35(7)8)62(102)88-49(31-90)66(106)82-39(17-14-15-19-70)59(99)87-48(68(108)109)27-51(72)92/h32-49,55,90H,14-31,70H2,1-13H3,(H2,71,91)(H2,72,92)(H,75,96)(H,76,97)(H,77,100)(H,78,93)(H,79,95)(H,80,94)(H,81,104)(H,82,106)(H,83,101)(H,84,98)(H,85,103)(H,86,107)(H,87,99)(H,88,102)(H,89,105)(H,108,109)(H3,73,74,110)/t38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,55-/m0/s1

0 references

JYSBHGIINWQTOH-JHTNTUONSA-N

0 references

2 references

15 September 2022

matched by identifier from

JYSBHGIINWQTOH-JHTNTUONSA-N

mapping relation type

1 reference

matched by identifier from

International Chemical Identifier

InChI=1S/C69H120N20O21/c1-32(2)21-41-57(97)76-30-54(95)79-42(22-33(3)4)60(100)77-38(13)56(96)75-29-53(94)80-46(26-50(71)91)63(103)85-47(28-52(93)78-43(23-34(5)6)61(101)83-41)64(104)81-40(18-16-20-74-69(73)110)58(98)84-45(25-36(9)10)65(105)89-55(37(11)12)67(107)86-44(24-35(7)8)62(102)88-49(31-90)66(106)82-39(17-14-15-19-70)59(99)87-48(68(108)109)27-51(72)92/h32-49,55,90H,14-31,70H2,1-13H3,(H2,71,91)(H2,72,92)(H,75,96)(H,76,97)(H,77,100)(H,78,93)(H,79,95)(H,80,94)(H,81,104)(H,82,106)(H,83,101)(H,84,98)(H,85,103)(H,86,107)(H,87,99)(H,88,102)(H,89,105)(H,108,109)(H3,73,74,110)/t38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,55-/m0/s1

UniChem compound ID

1 reference

Natural Product Atlas ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

JYSBHGIINWQTOH-JHTNTUONSA-N

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)

Retrieved from "https://www.wikidata.org/w/index.php?title=Q105137181&oldid=2158463733"