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Substance Name: Goserelin acetate
RN: 145781-92-6
UNII: 6YUU2PV0U8
InChIKey: IKDXDQDKCZPQSZ-JHYYTBFNSA-N

Note

  • A synthetic long-acting agonist of GONADOTROPIN-RELEASING HORMONE. Goserelin is used in treatments of malignant NEOPLASMS of the prostate, uterine fibromas, and metastatic breast cancer.

Molecular Formula

  • C59-H84-N18-O14.x-C2-H4-O2

Molecular Weight

  • 1329.4762
 

Classification Codes

  • Antineoplastic Agents
  • Antineoplastic Agents, Hormonal
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Names and Synonyms

Results Name

  • Goserelin acetate

Name of Substance

  • Goserelin
  • Goserelin acetate [JAN]

Synonyms

  • Fertilan
  • Goserelin acetate
  • UNII-6YUU2PV0U8

Systematic Name

  • 1-9-Luteinizing hormone-releasing factor (swine), 6-(O-(1,1-dimethylethyl)-D-serine)-, 2-(aminocarbonyl)hydrazide, acetate (salt)

Registry Numbers

CAS Registry Number

  • 145781-92-6

FDA UNII

  • 6YUU2PV0U8

System Generated Number

  • 0145781926

Molecular Formulas

Molecular Formula

  • C59-H84-N18-O14.x-C2-H4-O2

Molecular Formula Fragments

  • C2-H4-O2
  • C59-H84-N18-O14
  • COMPONENT

Structure Descriptors

InChI

InChI=1S/C59H84N18O14.C2H4O2/c1-31(2)22-40(49(82)68-39(12-8-20-64-57(60)61)56(89)77-21-9-13-46(77)55(88)75-76-58(62)90)69-54(87)45(29-91-59(3,4)5)74-50(83)41(23-32-14-16-35(79)17-15-32)70-53(86)44(28-78)73-51(84)42(24-33-26-65-37-11-7-6-10-36(33)37)71-52(85)43(25-34-27-63-30-66-34)72-48(81)38-18-19-47(80)67-38;1-2(3)4/h6-7,10-11,14-17,26-27,30-31,38-46,65,78-79H,8-9,12-13,18-25,28-29H2,1-5H3,(H,63,66)(H,67,80)(H,68,82)(H,69,87)(H,70,86)(H,71,85)(H,72,81)(H,73,84)(H,74,83)(H,75,88)(H4,60,61,64)(H3,62,76,90);1H3,(H,3,4)/t38-,39-,40-,41-,42-,43-,44-,45+,46-;/m0./s1

InChIKey

IKDXDQDKCZPQSZ-JHYYTBFNSA-N

Smiles

CC(C)C[C@H](NC(=O)[C@@H](COC(C)(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc4c[nH]cn4)NC(=O)[C@@H]5CCC(=O)N5)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N6CCC[C@H]6C(=O)NNC(=O)N.CC(=O)O