- 10 of 19 defined stereocentres
(2R,3S,4S,5R,6R)-2-{[(2R,3S,4R,5S,6S)-2-[2-{[(6-Amino-2-{3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl}-5-methyl-4-pyrimidinyl)carbonyl]amino}-3-({5-[(1-{[2-(4-{[4-(N-{4-[(diaminomethylene)am ino]butyl}carbamimidamido)butyl]carbamoyl}-2,4'-bi-1,3-thiazol-2'-yl)ethyl]amino}-3-hydroxy-1-oxo-2-butanyl)amino]-3-hydroxy-4-methyl-5-oxo-2-pentanyl}amino)-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dih ydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl carbamate hydrochloride (1:1)
[H]/N=C(\N)/N(CCCCNC(=O)c1csc(n1)c2csc(n2)CCNC(=O)C(C(C)O)NC(=O)C(C)C(C(C)NC(=O)C(C(c3cnc[nH]3)O[C@H]4[C@H]([C@@H]([C@@H]([C@@H](O4)CO)O)O)O[C@@H]5[C@H]([C@H]([C@@H]([C@H](O5)CO)O)OC(=O)N)O)NC(=O)c6c(c(nc(n6)C(CC(=O)N)NCC(C(=O)N)N)N)C)O)CCCCN=C(N)N.Cl
InChI=1S/C60H95N23O21S2.ClH/c1-23-36(79-49(82-47(23)63)28(15-34(62)87)74-16-27(61)48(64)93)53(97)81-38(44(29-17-70-22-75-29)102-57-46(42(91)40(89)32(18-84)101-57)103-56-43(92)45(104-60(69)99)41(90)33(19-85)100-56)54(98)76-25(3)39(88)24(2)50(94)80-37(26(4)86)52(96)72-12-9-35-77-31(21-105-35)55-78-30(20-106-55)51(95)71-10-5-7-13-83(59(67)68)14-8-6-11-73-58(65)66;/h17,20-22,24-28,32-33,37-46,56-57,74,84-86,88-92H,5-16,18-19,61H2,1-4H3,(H2,62,87)(H2,64,93)(H3,67,68)(H2,69,99)(H,70,75)(H,71,95)(H,72,96)(H,76,98)(H,80,94)(H,81,97)(H2,63,79,82)(H4,65,66,73);1H/t24?,25?,26?,27?,28?,32-,33+,37?,38?,39?,40+,41+,42+,43-,44?,45-,46-,56+,57-;/m0./s1
QFIGACVSDDJISY-AXICBEQGSA-N
CSID:39736, http://www.chemspider.com/Chemical-Structure.39736.html (accessed 02:36, Apr 19, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
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