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Substance Name: 31-45-beta-Inhibin (human)
RN: 414903-37-0
UNII: 041Y48Q3W4
InChIKey: ZRXXHPDJLAQCPC-SFJRRRFZSA-N

Molecular Formula

  • C73-H104-N18-O31-S3

Molecular Weight

  • 2039.1531
 
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Names and Synonyms

Name of Substance

  • 31-45-beta-Inhibin (human)

Synonyms

  • 31-45-beta-Inhibin (human)
  • UNII-041Y48Q3W4

Systematic Name

  • L-Threonine, L-alpha-glutamyl-L-tryptophyl-L-glutaminyl-L-threonyl-L-alpha-aspartyl-L-asparaginyl-L-cysteinyl-L-alpha-glutamyl-L-threonyl-L-cysteinyl-L-threonyl-L-cysteinyl-L-tyrosyl-L-alpha-glutamyl-

Registry Numbers

CAS Registry Number

  • 414903-37-0

FDA UNII

  • 041Y48Q3W4

System Generated Number

  • 0414903370

Structure Descriptors

InChI

1S/C82H119N21O34S3/c1-35(104)64(100-69(123)48(17-20-58(84)112)90-73(127)52(93-68(122)46(83)16-21-60(114)115)25-43-28-86-47-11-9-8-10-45(43)47)79(133)96-54(27-63(120)121)75(129)95-53(26-59(85)113)74(128)97-55(29-138-32-87-39(5)108)76(130)92-49(18-22-61(116)117)70(124)101-65(36(2)105)80(134)99-57(31-140-34-89-41(7)110)78(132)102-66(37(3)106)81(135)98-56(30-139-33-88-40(6)109)77(131)94-51(24-42-12-14-44(111)15-13-42)72(126)91-50(19-23-62(118)119)71(125)103-67(38(4)107)82(136)137/h8-15,28,35-38,46,48-57,64-67,86,104-107,111H,16-27,29-34,83H2,1-7H3,(H2,84,112)(H2,85,113)(H,87,108)(H,88,109)(H,89,110)(H,90,127)(H,91,126)(H,92,130)(H,93,122)(H,94,131)(H,95,129)(H,96,133)(H,97,128)(H,98,135)(H,99,134)(H,100,123)(H,101,124)(H,102,132)(H,103,125)(H,114,115)(H,116,117)(H,118,119)(H,120,121)(H,136,137)/t35-,36-,37-,38-,46+,48+,49+,50+,51+,52+,53+,54+,55+,56+,57+,64+,65+,66+,67+/m1/s1

InChIKey

ZRXXHPDJLAQCPC-SFJRRRFZSA-N

Smiles

C[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CSCNC(=O)C)NC(=O)[C@@H](NC(=O)[C@H](CSCNC(=O)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CSCNC(=O)C)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O