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Substance Name: Triglutamate folate
RN: 29701-38-0
InChIKey: BYLAPEVCLJECHH-NORTZESASA-N

Molecular Formula

  • C34-H40-N10-O15

Molecular Weight

  • 828.745
 
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Names and Synonyms

Name of Substance

  • Triglutamate folate

Synonym

  • Pteglu3

Systematic Name

  • L-Glutamic acid, N-(N-(N-(N-(4-(((2-amino-1,4-dihydro-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-L-gamma-glutamyl)-L-gamma-glutamyl)-L-gamma-glutamyl)-

Registry Numbers

CAS Registry Number

  • 29701-38-0

System Generated Number

  • 0029701380

Structure Descriptors

InChI

1S/C34H40N10O15/c35-18(29(52)53)5-8-21(45)34(12-11-23(47)48,32(58)59-24(49)10-7-20(37)31(56)57)44(22(46)9-6-19(36)30(54)55)28(51)15-1-3-16(4-2-15)39-13-17-14-40-26-25(41-17)27(50)43-33(38)42-26/h1-4,14,18-20,39H,5-13,35-37H2,(H,47,48)(H,52,53)(H,54,55)(H,56,57)(H3,38,40,42,43,50)/t18-,19-,20-,34+/m0/s1

InChIKey

BYLAPEVCLJECHH-NORTZESASA-N

Smiles

c1cc(ccc1C(=O)N(C(=O)CC[C@@H](C(=O)O)N)[C@](CCC(=O)O)(C(=O)CC[C@@H](C(=O)O)N)C(=O)OC(=O)CC[C@@H](C(=O)O)N)NCc2cnc3c(n2)c(=O)nc([nH]3)N