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Substance Name: Axinastatin 1
RN: 137647-92-8
InChIKey: PICZCWCKOLHDOJ-GHTSNYPWSA-N

Note

  • From marine sponge Axinella sp.

Molecular Weight

  • 752.908
 
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Names and Synonyms

Name of Substance

  • Axinastatin 1

Synonym

  • Cyclo(asn-pro-phe-val-val-pro-val)

Systematic Name

  • Axinastatin 1

Registry Numbers

CAS Registry Number

  • 137647-92-8

System Generated Number

  • 0137647928

Structure Descriptors

InChI

1S/C38H56N8O8/c1-20(2)29-35(51)41-25(19-28(39)47)37(53)45-16-10-14-26(45)33(49)40-24(18-23-12-8-7-9-13-23)32(48)42-30(21(3)4)36(52)44-31(22(5)6)38(54)46-17-11-15-27(46)34(50)43-29/h7-9,12-13,20-22,24-27,29-31H,10-11,14-19H2,1-6H3,(H2,39,47)(H,40,49)(H,41,51)(H,42,48)(H,43,50)(H,44,52)/t24-,25-,26-,27-,29-,30-,31-/m0/s1

InChIKey

PICZCWCKOLHDOJ-GHTSNYPWSA-N

Smiles

C1([C@@H]2CCCN2C(=O)[C@H](CC(=O)N)NC([C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)C)NC([C@H](C(C)C)NC(=O)[C@@H](Cc2ccccc2)N1)=O)=O)=O