SCY I

CAS No.
CCD No.
CCD03289958
Formula
C59 H86 N12 O14 S
MolWeight
1219.46

Basic Information

Product Name: SCY I
English Synonyms: SCYLIORHININ I ; SCY I ; SHARK SUBSTANCE P RELATED PEPTIDE
MDL Number.: MFCD17018913
H bond acceptor: 26
H bond donor: 15
Smile: CC(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N
InChi: InChI=1S/C59H86N12O14S/c1-35(2)29-44(55(80)67-43(59(84)85)25-28-86-4)64-49(73)34-63-52(77)45(32-39-21-23-40(72)24-22-39)68-56(81)46(30-37-15-7-5-8-16-37)70-54(79)42(20-12-14-27-61)66-58(83)48(33-50(74)75)71-57(82)47(31-38-17-9-6-10-18-38)69-53(78)41(19-11-13-26-60)65-51(76)36(3)62/h5-10,15-18,21-24,35-36,41-48,72H,11-14,19-20,25-34,60-62H2,1-4H3,(H,63,77)(H,64,73)(H,65,76)(H,66,83)(H,67,80)(H,68,81)(H,69,78)(H,70,79)(H,71,82)(H,74,75)(H,84,85)/t36-,41-,42-,43-,44-,45-,46-,47-,48-/m0/s1
InChiKey: InChIKey=LXZRFASCYIUNKR-SRYPMHJGSA-N

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