Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: alpha-Amanitin, 4-(2-mercapto-6-methoxy-1-methyl-L-tryptophan)-
RN: 79513-34-1
InChIKey: MMTDIPRJCDAHGJ-UHFFFAOYSA-N

Molecular Formula

  • C41-H58-N10-O14-S

Molecular Weight

  • 947.031
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

  • alpha-Amanitin, 4-(2-mercapto-6-methoxy-1-methyl-L-tryptophan)-

Registry Numbers

CAS Registry Number

  • 79513-34-1

System Generated Number

  • 0079513341

Structure Descriptors

InChI

1S/C41H58N10O14S/c1-6-18(2)33-38(61)44-13-31(56)45-26-17-66(64)41-23(22-8-7-21(65-5)10-27(22)50(41)4)11-24(35(58)43-14-32(57)48-33)46-39(62)34(19(3)29(54)16-52)49-37(60)28-9-20(53)15-51(28)40(63)25(12-30(42)55)47-36(26)59/h7-8,10,18-20,24-26,28-29,33-34,52-54H,6,9,11-17H2,1-5H3,(H2,42,55)(H,43,58)(H,44,61)(H,45,56)(H,46,62)(H,47,59)(H,48,57)(H,49,60)

InChIKey

MMTDIPRJCDAHGJ-UHFFFAOYSA-N

Smiles

c1c(cc2n(c3c(c2c1)C[C@@H]1NC([C@@H]([C@@H](C)[C@@H](CO)O)NC([C@@H]2N(C([C@@H](CC(=O)N)NC([C@@H](C[S@@]3=O)NC(CNC([C@@H](NC(CNC1=O)=O)[C@@H](C)CC)=O)=O)=O)=O)C[C@@H](C2)O)=O)=O)C)OC