CHEBI:227606 - Laxitextine B

ChEBI IDCHEBI:227606
ChEBI NameLaxitextine B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H34O7
Net Charge0
Average Mass446.540
Monoisotopic Mass446.23045
SMILESCC(C)C1=C2[C@@H]3CC=C4[C@H]5O[C@@]6(O)[C@]7(O)[C@H](OC[C@@]6(O)O5)O[C@H]([C@H]47)[C@@]3(C)CC[C@]2(C)CC1
InChIInChI=1S/C25H34O7/c1-12(2)13-7-8-21(3)9-10-22(4)15(16(13)21)6-5-14-17-18(22)30-20-24(17,27)25(28)23(26,11-29-20)31-19(14)32-25/h5,12,15,17-20,26-28H,6-11H2,1-4H3/t15-,17-,18+,19+,20+,21-,22-,23+,24+,25+/m0/s1
InChIKeySZSZXZMZHMANSY-ZHLUXVLASA-N
Species of MetaboliteComponentSourceComments
Laxitextum incrustatum (ncbitaxon:1812024) - PubMed (27043217)
ChEBI Ontology
Outgoing Relation(s)
Laxitextine B (CHEBI:227606) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(1S,5S,10S,13S,14R,16R,19R,21R,23S,24R)-10,13-dimethyl-7-propan-2-yl-15,17,20,22-tetraoxaheptacyclo[12.10.0.02,21.05,13.06,10.016,24.019,23]tetracosa-2,6-diene-19,23,24-triol