Skip Navigation
ChemIDplus A TOXNET DATABASE Lite•Browse•Advanced

Substance Name: 16-Anhydrodigitalinum verum monoacetate
ID: BW38500000
InChIKey: UNGWDXJPODTXHU-LCNSXCGNSA-N

Classification Code

  • Natural Product

Molecular Formula

  • C38-H56-O14

Molecular Weight

  • 804.9646
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

  • 16-Anhydrodigitalinum verum monoacetate

Registry Numbers

ID Number

  • NIOSH/BW3850000

System Generated Number

  • BW38500000

Structure Descriptors

InChI

1S/C43H64O14/c1-21-38(54-24(4)44)31(45)18-36(52-21)56-40-23(3)53-37(19-33(40)47)57-39-22(2)51-35(17-32(39)46)55-27-9-12-41(5)26(16-27)7-8-30-29(41)10-13-42(6)28(11-14-43(30,42)49)25-15-34(48)50-20-25/h11,15,21-23,26-27,29-33,35-40,45-47,49H,7-10,12-14,16-20H2,1-6H3/t21-,22-,23-,26+,27+,29+,30+,31+,32+,33+,35+,36+,37+,38-,39-,40-,41+,42-,43+/m1/s1

InChIKey

UNGWDXJPODTXHU-LCNSXCGNSA-N

Smiles

C[C@H]1O[C@H](C[C@H](O)[C@@H]1O[C@H]2C[C@H](O)[C@H](O[C@H]3C[C@H](O)[C@H](OC(=O)C)[C@@H](C)O3)[C@@H](C)O2)O[C@H]4CC[C@@]5(C)[C@@H](CC[C@H]6[C@@H]5CC[C@]7(C)C(=CC[C@]67O)C8=CC(=O)OC8)C4