stigmatellin A (Q7616496)

stigmatellin a (English)

2-[(3S,4R,5S,6S,7E,9E,11E)-4,6-Dimethoxy-3,5,11-trimethyltrideca-7,9,11-trien-1-yl]-8-hydroxy-5,7-dimethoxy-3-methyl-4H-1-benzopyran-4-one

5 October 2016

stereoisomer of

2 references

inferred from InChIKey

2-[(3R,4R,5R,6S,7E,9E,11E)-4,6-dimethoxy-3,5,11-trimethyltrideca-7,9,11-trienyl]-8-hydroxy-5,7-dimethoxy-3-methylchromen-4-one

inferred from InChI

1 reference

2-[(3R,4S,5S,6S,7E,9E,11E)-4,6-dimethoxy-3,5,11-trimethyltrideca-7,9,11-trienyl]-8-hydroxy-5,7-dimethoxy-3-methylchromen-4-one

inferred from InChI

1 reference

inferred from InChI

chemical formula

C₃₀H₄₂O₇

1 reference

stigmatellin a (English)

5 October 2016

canonical SMILES

CC=C(C)C=CC=CC(C(C)C(C(C)CCC1=C(C(=O)C2=C(O1)C(=C(C=C2OC)OC)O)C)OC)OC

1 reference

stigmatellin a (English)

5 October 2016

isomeric SMILES

C/C=C(\C)/C=C/C=C/[C@@H]([C@@H](C)[C@H]([C@@H](C)CCC1=C(C(=O)C2=C(O1)C(=C(C=C2OC)OC)O)C)OC)OC

1 reference

stigmatellin a (English)

5 October 2016

found in taxon

Stigmatella aurantiaca

5 references

Stigmatellin, a new antibiotic from Stigmatella aurantiaca (Myxobacterales). I. Production, physico-chemical and biological properties

Stigmatellin, a new antibiotic from Stigmatella aurantiaca (Myxobacterales). I. Production, physico-chemical and biological properties

Stigmatellin, a new antibiotic from Stigmatella aurantiaca (Myxobacterales). I. Production, physico-chemical and biological properties

The mode of action of stigmatellin, a new inhibitor of the cytochrome b-c1 segment of the respiratory chain

Stigmatellin, a new antibiotic from Stigmatella aurantiaca (Myxobacterales). I. Production, physico-chemical and biological properties

subject has role

antibiotic

1 reference

InChI=1S/C30H42O7/c1-10-18(2)13-11-12-14-22(33-6)21(5)29(36-9)19(3)15-16-23-20(4)27(31)26-24(34-7)17-25(35-8)28(32)30(26)37-23/h10-14,17,19,21-22,29,32H,15-16H2,1-9H3/b13-11+,14-12+,18-10+/t19-,21+,22-,29-/m0/s1

Medical Subject Headings

15 March 2018

0 references

0 references

0 references

Identifiers

InChI

1 reference

stigmatellin a (English)

UZHDGDDPOPDJGM-CVOZLMQJSA-N

5 October 2016

InChIKey

2 references

stigmatellin a (English)

5 October 2016

ChEBI release 2020-09-01

1 reference

stigmatellin A (English)

5 October 2016

1 reference

Stigmatellin (English)

5 October 2016

1 reference

stigmatellin a (English)

5 October 2016

Reaxys registry number

8595371

1 reference

stigmatellin A (English)

5 October 2016

ChEBI ID

32155

mapping relation type

3 references

stigmatellin A (English)

5 October 2016

matched by identifier from

ChEBI release 2019-10-02

International Chemical Identifier

InChI

InChI=1S/C30H42O7/c1-10-18(2)13-11-12-14-22(33-6)21(5)29(36-9)19(3)15-16-23-20(4)27(31)26-24(34-7)17-25(35-8)28(32)30(26)37-23/h10-14,17,19,21-22,29,32H,15-16H2,1-9H3/b13-11+,14-12+,18-10+/t19-,21+,22-,29-/m0/s1

1 reference

DSSTOX compound identifier

STIGMATELLIN (English)

5 October 2016

1 reference

0 references

DTXCID20889778

0 references

EC number

620-944-2

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.149.842

27 December 2018

ECHA Substance Infocard ID

[No public or meaningful name is available] (English)

quotation

CAS no.: 91682-96-1 (English)

100.149.842

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.149.842

27 December 2018

[No public or meaningful name is available] (English)

quotation

CAS no.: 91682-96-1 (English)

MeSH descriptor ID

C041573

1 reference

Medical Subject Headings

14 March 2018

1 reference

stigmatellin A (English)

5 October 2016

1 reference

stigmatellin A (English)

inferred by common MeSH mappings on source and on Wikidata

5 October 2016

Freebase ID

/m/02qw0f6

0 references

Microsoft Academic ID

0 references

1 reference

UMLS 2023