Goadsporin

More details:

• Systematic name

  N-[(2-{(1S)-1-[(N-{[2-(1-{[N-({2-[(1S)-1-Acetamidoethyl]-5-methyl-1,3-oxazol-4-yl}carbonyl)-L-valyl]amino}vinyl)-5-methyl-1,3-oxazol-4-yl]carbonyl}-L-isoleucyl)amino]-3-methylbutyl}-1,3-thiazol-4-yl)c arbonyl]-L-seryl-N-[(4-{[(2S)-1-{[1-(4-{[(2S)-1-{[(4-{[(1S)-1-carboxy-2-methylpropyl]carbamoyl}-1,3-thiazol-2-yl)methyl]amino}-1-oxo-2-propanyl]carbamoyl}-1,3-oxazol-2-yl)vinyl]amino}-4-methyl-1-oxo-2 -pentanyl]carbamoyl}-5-methyl-1,3-oxazol-2-yl)methyl]glycinamide

• SMILES

  CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(C)C)c1nc(cs1)C(=O)N[C@@H](CO)C(=O)NCC(=O)NCc2nc(c(o2)C)C(=O)N[C@@H](CC(C)C)C(=O)NC(=C)c3nc(co3)C(=O)N[C@@H](C)C(=O)NCc4nc(cs4)C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)c5c(oc(n5)C(=C)NC(=O)[C@H](C(C)C)NC(=O)c6c(oc(n6)[C@H](C)NC(=O)C)C)C

• Std. InChi

  InChI=1S/C72H97N19O20S2/c1-19-33(10)53(89-67(105)56-40(17)111-70(91-56)37(14)79-63(101)51(31(6)7)87-66(104)55-39(16)110-69(90-55)36(13)76-41(18)93)64(102)82-43(21-30(4)5)71-85-47(28-113-71)61(99)83-44(25-92)58(96)74-22-48(94)73-23-49-86-54(38(15)109-49)65(103)81-42(20-29(2)3)59(97)78-35(12)68-84-45(26-108-68)60(98)77-34(11)57(95)75-24-50-80-46(27-112-50)62(100)88-52(32(8)9)72(106)107/h26-34,36,42-44,51-53,92H,12,14,19-25H2,1-11,13,15-18H3,(H,73,94)(H,74,96)(H,75,95)(H,76,93)(H,77,98)(H,78,97)(H,79,101)(H,81,103)(H,82,102)(H,83,99)(H,87,104)(H,88,100)(H,89,105)(H,106,107)/t33-,34-,36-,42-,43-,44-,51-,52-,53-/m0/s1

• Std. InChIKey

  JYUWJUDWHAUBBT-SQDQPZCFSA-N

• Cite this record

  CSID:57641759, http://www.chemspider.com/Chemical-Structure.57641759.html (accessed 10:45, Jun 12, 2024)