Chem
J-GLOBAL ID:200907075712564911
Nikkaji number:J33.170H Triptorelin トリプトレリン
Download MOL file Substance type: Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C64 H82 N18 O13 Molecular formula furigana:
C64-H82-N18-O13
Molecular weight:
1311.473
InChI:
InChI=1S/C64H82N18O13/c1-34(2)23-46(56(88)75-45(13-7-21-69-64(66)67)63(95)82-22-8-14-52(82)62(94)72-31-53(65)85)76-58(90)48(25-36-28-70-42-11-5-3-9-40(36)42)78-57(89)47(24-35-15-17-39(84)18-16-35)77-61(93)51(32-83)81-59(91)49(26-37-29-71-43-12-6-4-10-41(37)43)79-60(92)50(27-38-30-68-33-73-38)80-55(87)44-19-20-54(86)74-44/h3-6,9-12,15-18,28-30,33-34,44-52,70-71,83-84H,7-8,13-14,19-27,31-32H2,1-2H3,(H2,65,85)(H,68,73)(H,72,94)(H,74,86)(H,75,88)(H,76,90)(H,77,93)(H,78,89)(H,79,92)(H,80,87)(H,81,91)(H4,66,67,69)/t44-,45-,46-,47-,48+,49-,50-,51-,52-/m0/s1
InChI key:
VXKHXGOKWPXYNA-PGBVPBMZSA-N
SMILES:
CC(C)C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N
Systematic name (5): 5-オキソ-L-Pro-L-His-L-Trp-L-Ser-L-Tyr-D-Trp-L-Leu-L-Arg-L-Pro-Gly-NH2 pGlu-L-His-L-Trp-L-Ser-L-Tyr-D-Trp-L-Leu-L-Arg-L-Pro-Gly-NH2 5-オキソ-Pro-His-Trp-Ser-Tyr-D-Trp-Leu-Arg-Pro-Gly-NH2 (2S)-N-[(2S)-5-カルバムイミドアミド-1-[(2S)-2-[(カルバモイルメチル)カルバモイル]ピロリジン-1-イル]-1-オキソペンタン-2-イル]-2-[(2R)-2-[(2S)-2-[(2S)-3-ヒドロキシ-2-[(2S)-2-[(2S)-3-(1H-イミダゾール-4-イル)-2-{[(2S)-5-オキソピロリジン-2-イル]ホルムアミド}プロパンアミド]-3-(1H-インドール-3-イル)プロパンアミド]プロパンアミド]-3-(4-ヒドロキシフェニル)プロパンアミド]-3-(1H-インドール-3-イル)プロパンアミド]-4-メチルペンタンアミド (2S)-N-[(2S)-5-carbamimidamido-1-[(2S)-2-[(carbamoylmethyl)carbamoyl]pyrrolidin-1-yl]-1-oxopentan-2-yl]-2-[(2R)-2-[(2S)-2-[(2S)-3-hydroxy-2-[(2S)-2-[(2S)-3-(1H-imidazol-4-yl)-2-{[(2S)-5-oxopyrrolidin-2-yl]formamido}propanamido]-3-(1H-indol-3-yl)propanamido]propanamido]-3-(4-hydroxyphenyl)propanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanamide Other name (14): トリプトレリン Triptorelin 5-Oxo-L-Pro-L-His-L-Trp-L-Ser-L-Tyr-D-Trp-L-Leu-L-Arg-L-Pro-Gly-NH2 デカペプチル Triptoreline
[D-Trp6 ]黄体形成ホルモン放出ホルモン Decapeptyl CL-118532 [D-Trp6 ]LH-RH Wy-42462 AY-25650 [D-Trp6 ]LHRH 5-Oxo-Pro-His-Trp-Ser-Tyr-D-Trp-Leu-Arg-Pro-Gly-NH2 [D-Trp6 ]Luteinizing hormone-releasing hormone Show all
CAS registry number:
57773-63-4
Application (3):
contraceptive agent
, Gonadotropin-ReleasingHormone
, antitumor drug
Thsaurus map: Return to Previous Page