geldanamycin (Q904475)

inferred from isomeric SMILES

stereoisomer of

[(3R,5R,6S,7R,8E,10R,11R,12Z,14E)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate

2 references

inferred from InChIKey

carbamic acid [(3R,5S,6R,7S,10S,11S)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] ester

inferred from InChI

2 references

inferred from InChIKey

[(4Z,6Z,8R,9R,10Z,12R,13S,14R,16R)-13-hydroxy-8,14,19-trimethoxy-4,10,12,16-tetramethyl-3,20,22-trioxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18-pentaen-9-yl] carbamate

inferred from InChI

1 reference

inferred from InChI

chemical formula

C₂₉H₄₀N₂O₉

2 references

Streptomyces hygroscopicus

COC1=C2CC(C)CC(OC)C(O)C(C)C=C(C)C(OC(N)=O)C(OC)C=CC=C(C)C(=O)NC(=CC1=O)C2=O

0 references

isomeric SMILES

C[C@H]1C[C@@H]([C@@H]([C@H](/C=C(/[C@@H]([C@H](/C=C\C=C(\C(=O)NC2=CC(=O)C(=C(C1)C2=O)OC)/C)OC)OC(=O)N)\C)C)O)OC

0 references

found in taxon

3 references

Herbicidal effects of geldanamycin and nigericin, antibiotics from Streptomyces hygroscopicus

The LuxR family members GdmRI and GdmRII are positive regulators of geldanamycin biosynthesis in Streptomyces hygroscopicus 17997.

19-[(1'S,4'R)-4'-Hydroxy-1'-methoxy-2'-oxopentyl]geldanamycin, a natural geldanamycin analogue from Streptomyces hygroscopicus 17997.

Humicola fuscoatra

1 reference

Study of marine natural products including resorcyclic acid lactones from Humicola fuscoatra that reactivate latent HIV-1 expression in an in vitro model of central memory CD4+ T cells

subject has role

antineoplastic antibiotics

1 reference

15 March 2018

1 reference

15 March 2018

1 reference

cysteine proteinase inhibitors

MeSH descriptor ID

C001277

retrieved

15 March 2018

1 reference

InChI=1S/C29H40N2O9/c1-15-11-19-25(34)20(14-21(32)27(19)39-7)31-28(35)16(2)9-8-10-22(37-5)26(40-29(30)36)18(4)13-17(3)24(33)23(12-15)38-6/h8-10,13-15,17,22-24,26,33H,11-12H2,1-7H3,(H2,30,36)(H,31,35)/b10-8-,16-9+,18-13+/t15-,17+,22+,23+,24-,26+/m1/s1

MeSH descriptor ID

C001277

retrieved

15 March 2018

Identifiers

InChI

0 references

1 reference

ChEBI release 2020-09-01

CAS Registry Number

30562-34-6

2 references

Italian Wikipedia

https://commonchemistry.cas.org/detail?cas_rn=30562-34-6

9 April 2021

ChemSpider ID

10272739

1 reference

English Wikipedia

PubChem CID

5288382

1 reference

ChEBI ID

5292

mapping relation type

exact match

1 reference

International Chemical Identifier

InChI

InChI=1S/C29H40N2O9/c1-15-11-19-25(34)20(14-21(32)27(19)39-7)31-28(35)16(2)9-8-10-22(37-5)26(40-29(30)36)18(4)13-17(3)24(33)23(12-15)38-6/h8-10,13-15,17,22-24,26,33H,11-12H2,1-7H3,(H2,30,36)(H,31,35)/b10-8-,16-9+,18-13+/t15-,17+,22+,23+,24-,26+/m1/s1

ChEMBL ID

CHEMBL278315

1 reference

2 references

inferred from InChIKey

1 reference

1 reference

DSSTOX compound identifier

0 references

0 references

0 references

Guide to Pharmacology Ligand ID

9829

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

5 February 2021

1 reference

14 March 2018

1 reference

0 references

1 reference

reason for deprecated rank

Natural Product Atlas ID

NPA019914

cannot be confirmed by other sources

1 reference

Wikimedia import URL

https://www.wikidata.org/w/index.php?title=Wikidata:Property_proposal/Natural_Product_Atlas_ID&oldid=1080339663

0 references

1 reference

https://docs.openalex.org/download-snapshot/snapshot-data-format

Serbo-Croatian Wikipedia

0 references

1 reference

28 October 2013

Microsoft Academic ID

0 references

1 reference

26 January 2022

UMLS CUI

C0061179

1 reference

inferred by common MeSH mappings on source and on Wikidata