CHEBI:202883 - NW-G06

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name NW-G06
ChEBI ID CHEBI:202883
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C36H47ClN10O8
Net Charge 0
Average Mass 783.280
Monoisotopic Mass 782.32669
InChI InChI=1S/C36H47ClN10O8/c1-18(2)28-34(53)46-25(9-7-13-39-46)33(52)47-26(15-21(55-5)17-40-47)31(50)43(4)19(3)30(49)45-24(8-6-12-38-45)32(51)44-27(29(48)42-28)16-36(54)22-11-10-20(37)14-23(22)41-35(36)44/h10-11,14-15,17-19,24-28,35,38-39,41,54H,6-9,12-13,16H2,1-5H3,(H,42,48)/t19-,24+,25+,26?,27-,28+,35-,36+/m0/s1
InChIKey QUIDVZCZDYUVMF-IVKKAPITSA-N
SMILES ClC1=CC=2N[C@H]3N4C(=O)[C@@H]5N(NCCC5)C(=O)[C@@H](N(C(=O)C6N(N=CC(=C6)OC)C([C@@H]7N(C([C@H](NC([C@@H]4C[C@]3(C2C=C1)O)=O)C(C)C)=O)NCCC7)=O)C)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing NW-G06 (CHEBI:202883) is a pyrroloindole (CHEBI:48133)
IUPAC Name
(3R,10S,20R,27R,30S,32R,40S)-36-chloro-32-hydroxy-15-methoxy-10,11-dimethyl-27-propan-2-yl-1,7,8,11,17,18,24,25,28,39-decazaheptacyclo[28.10.0.03,8.013,18.020,25.032,40.033,38]tetraconta-14,16,33(38),34,36-pentaene-2,9,12,19,26,29-hexone
Manual Xref Database
28497171 ChemSpider
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