Keyword(s): Natural Toxins
Molecule Category Free-form
EPA CompTox DTXSID40981329

Structure

InChI Key SGYGAUUUPXBOSA-PTSVTHRZSA-N
Smiles CCC(C)C(=O)O[C@H]1CC[C@]2(C3[C@@]1(O[C@@]24CC5C6CN7C[C@H](CC[C@H]7[C@@](C6[C@H](C([C@]5(C4[C@@H](C3)O)O)OC(=O)C(C)(CC)O)O)(C)O)C)O)C
InChI
InChI=1S/C37H59NO11/c1-8-19(4)30(41)47-25-12-13-32(5)23-14-22(39)28-35(32,49-37(23,25)46)15-21-20-17-38-16-18(3)10-11-24(38)34(7,44)26(20)27(40)29(36(21,28)45)48-31(42)33(6,43)9-2/h18-29,39-40,43-46H,8-17H2,1-7H3/t18-,19?,20?,21?,22+,23?,24-,25-,26?,27+,28?,29?,32-,33?,34+,35+,36-,37-/m0/s1č

Physicochemical Descriptors

Property Name Value
Molecular Formula C37H59NO11

Cross References

Resources Reference
CAS NUMBER 63951-45-1
NORMAN SUSDAT
PubChem 45690
ChemSpider 41577.0