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Substance Name: Avellanin B
RN: 110297-46-6
InChIKey: QMLRGCQMEXZWGZ-UADCXJISSA-N

Note

  • From Hamigera avellanea stolk et Samson; increases blood pressure.

Molecular Weight

  • 547.6523
 
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Names and Synonyms

Name of Substance

  • Avellanin B

Synonym

  • Cyclo(N-Me-phe-ala-val-2-aminobenzoyl-pro)

Systematic Name

  • Cyclo(alanylvalyl-2-aminobenzoylprolyl-N-methylphenylalanyl)

Registry Numbers

CAS Registry Number

  • 110297-46-6

System Generated Number

  • 0110297466

Structure Descriptors

InChI

1S/C30H37N5O5/c1-18(2)25(34-28(39)19(3)31)26(37)24(20-11-6-5-7-12-20)30(17-36,27(38)21-13-8-9-14-22(21)32)35(4)29(40)23-15-10-16-33-23/h5-9,11-14,17,19,23-25,33H,1,10,15-16,31-32H2,2-4H3,(H,34,39)/t19-,23+,24?,25+,30+/m1/s1

InChIKey

QMLRGCQMEXZWGZ-UADCXJISSA-N

Smiles

C[C@H](C(=O)N[C@@H](C(=C)C)C(=O)C(c1ccccc1)[C@@](C=O)(C(=O)c2ccccc2N)N(C)C(=O)[C@@H]3CCCN3)N