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Substance Name: GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)-
RN: 61012-20-2
InChIKey: FLILNWDVJWBIBP-OCOCDLJMSA-N

Molecular Formula

  • C62-H90-N16-O12-S

Molecular Weight

  • 1283.559
 
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Names and Synonyms

Name of Substance

  • GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)-

Synonym

  • EINECS 262-558-3

Systematic Name

  • Luteinizing hormone-releasing factor (pig), 6-(3-((1,1-dimethylethyl)thio)-d-valine)-9-(N-ethyl-l-prolinamide)-10-deglycinamide-

Registry Numbers

CAS Registry Number

  • 61012-20-2

System Generated Number

  • 0061012202

Structure Descriptors

InChI

1S/C62H90N16O12S/c1-9-66-57(88)48-17-13-25-78(48)59(90)42(16-12-24-67-60(63)64)71-52(83)43(26-34(2)3)75-58(89)50(62(7,8)91-61(4,5)6)77-55(86)44(27-35-18-20-38(80)21-19-35)72-56(87)47(32-79)76-53(84)45(28-36-30-68-40-15-11-10-14-39(36)40)73-54(85)46(29-37-31-65-33-69-37)74-51(82)41-22-23-49(81)70-41/h10-11,14-15,18-21,30-31,33-34,41-48,50,68,79-80H,9,12-13,16-17,22-29,32H2,1-8H3,(H,65,69)(H,66,88)(H,70,81)(H,71,83)(H,72,87)(H,73,85)(H,74,82)(H,75,89)(H,76,84)(H,77,86)(H4,63,64,67)/t41-,42-,43-,44-,45-,46-,47-,48-,50-/m0/s1

InChIKey

FLILNWDVJWBIBP-OCOCDLJMSA-N

Smiles

CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C(C)(C)SC(C)(C)C)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc3c[nH]c4c3cccc4)NC(=O)[C@H](Cc5cnc[nH]5)NC(=O)[C@@H]6CCC(=O)N6