SIVMAC239-31_ChemCD

SIVMAC239-31

basic_info
Product_Name：	SIVMAC239-31
EnglishSynonyms：	SIVMAC239-31 ; H-THR-SER-ARG-PRO-THR-ALA-PRO-SER-SER-GLY-ARG-GLY-GLY-ASN-TYR-OH ; TSRPTAPSSGRGGNY
pro_mdlNumber：	MFCD03790678
pro_acceptors：	45
pro_donors：	27
pro_smile：	C[C@H]([C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](Cc3ccc(cc3)O)C(=O)O)N)O
InChi：	InChI=1S/C61H98N22O23/c1-28(73-56(102)47(30(3)88)81-54(100)41-11-7-19-83(41)58(104)34(9-5-17-69-61(66)67)76-51(97)39(27-86)80-55(101)46(63)29(2)87)57(103)82-18-6-10-40(82)53(99)79-38(26-85)52(98)78-37(25-84)49(95)72-24-45(93)74-33(8-4-16-68-60(64)65)48(94)71-22-43(91)70-23-44(92)75-35(21-42(62)90)50(96)77-36(59(105)106)20-31-12-14-32(89)15-13-31/h12-15,28-30,33-41,46-47,84-89H,4-11,16-27,63H2,1-3H3,(H2,62,90)(H,70,91)(H,71,94)(H,72,95)(H,73,102)(H,74,93)(H,75,92)(H,76,97)(H,77,96)(H,78,98)(H,79,99)(H,80,101)(H,81,100)(H,105,106)(H4,64,65,68)(H4,66,67,69)/t28-,29+,30+,33-,34-,35-,36-,37-,38-,39-,40-,41-,46-,47-/m0/s1
InChiKey：	InChIKey=OKFXIEPMCAHXDC-WMCDTTINSA-N

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