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CHEBI:214612 - Streptodepsipeptide P11B

ChEBI IDCHEBI:214612
ChEBI NameStreptodepsipeptide P11B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC52H86N6O18
Net Charge0
Average Mass1083.284
Monoisotopic Mass1082.59986
SMILESCC(C)[C@@H]1NC(=O)[C@H](C)OC(=O)[C@@H](C(C)C)NC(=O)[C@@H](C(C)C)OC(=O)[C@H](C(C)C)NC(=O)[C@@H](C)OC(=O)[C@@H](C(C)C)NC(=O)[C@@H](C(C)C)OC(=O)[C@H](C(C)C)NC(=O)[C@H](C)OC(=O)[C@@H](C(C)C)NC(=O)[C@H](C)OC1=O
InChIInChI=1S/C52H86N6O18/c1-21(2)33-47(65)71-29(17)41(59)53-34(22(3)4)48(66)72-31(19)43(61)55-37(25(9)10)51(69)75-40(28(15)16)46(64)58-36(24(7)8)50(68)74-32(20)44(62)56-38(26(11)12)52(70)76-39(27(13)14)45(63)57-35(23(5)6)49(67)73-30(18)42(60)54-33/h21-40H,1-20H3,(H,53,59)(H,54,60)(H,55,61)(H,56,62)(H,57,63)(H,58,64)/t29-,30-,31-,32+,33-,34+,35+,36+,37-,38-,39+,40+/m0/s1
InChIKeyRDYHVUCOTYFAJX-VPAXYXAKSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies P11-23B (ncbitaxon:1740610) - PubMed (28049552)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Streptodepsipeptide P11B (CHEBI:214612) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(3S,6S,9R,12R,15S,18S,21R,24R,27S,30S,33R,36R)-6,12,18,30-tetramethyl-3,9,15,21,24,27,33,36-octa(propan-2-yl)-1,7,13,19,25,31-hexaoxa-4,10,16,22,28,34-hexazacyclohexatriacontane-2,5,8,11,14,17,20,23,26,29,32,35-dodecone
Manual XrefsDatabases
78443439ChemSpider