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Compounds

COMPOUND NPA016433

STRUCTURE

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PROPERTIES

NPAID	NPA016433
CLUSTER ID	257
NODE ID	234
NAME	Quartromicin A1
FORMULA	C77H102O30
MOLECULAR WEIGHT (Da)	1507.6330
ACCURATE MASS (Da)	1506.6456
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Amycolatopsis
ORIGIN SPECIES	orientalis Q427-8 ATCC 53884
InChIKey	JJNPIRKBXBBKHB-ZCHHKXHMSA-N
InChI	InChI=1S/C77H98O30/c1-34-12-10-14-44-20-40(32-100-69-59(90)57(88)55(86)47(30-80)102-69)36(3)21-74(44)61(92)49(65(96)104-74)45(82)15-18-72(8)25-41(28-78)38(5)23-77(72)64(95)52(68(99)107-77)54(85)35(2)13-11-17-71(7)27-43(33-101-70-60(91)58(89)56(87)48(31-81)103-70)39(6)24-75(71)62(93)50(66(97)105-75)46(83)16-19-73(9)26-42(29-79)37(4)22-76(73)63(94)51(53(34)84)67(98)106-76/h10-20,25-29,36-39,44-60,65-70,80-91H,21-24,30-33H2,1-9H3/q-4/b14-10-,17-11?,18-15-,19-16-,34-12-,35-13-/t36?,37?,38?,39?,44?,45?,46?,47-,48-,49?,50?,51?,52?,53?,54?,55+,56+,57+,58+,59-,60-,65?,66?,67?,68?,69+,70+,71?,72?,73?,74?,75?,76?,77?/m1/s1AuxInfo=1/0/N:92,68,1,89,65,83,69,62,86,7,37,8,38,6,53,23,36,52,22,93,3,17,47,31,50,20,34,63,87,103,78,95,70,9,39,2,18,48,32,94,49,19,33,5,54,24,101,76,55,25,11,41,10,40,100,75,99,74,98,73,56,29,15,45,58,26,12,42,97,72,35,51,21,4,28,14,44,64,88,104,79,61,85,91,67,105,80,106,81,107,82,57,30,16,46,60,84,90,66,96,71,102,77,59,27,13,43/it:im/CRV:96-1,97-1,98-1,99-1/rA:107CCCCCCCCCCCCOCCOCCCCCCCCCCOCCOCCCCCCCCCCCCOCCOCCCCCCCCCCOCOO-OCCOCO-OCCCOC.eC.oC.eC.eC.eOCOOOOCO-OCCOCO-OCCCCOC.eC.oC.eC.eC.eOCOOOO/rB:s1;s2;s3;s4;s5;d-6;s7;d-8;s9;s10;s11;s12;s13;s11s14;d15;s14;s17;s18;d19;s14s20;s21;d?22;s23;s24;s25;s26;s27;s25s28;d29;s28;s31;s32;d33;s28s34;s35;d?36;s37;d?38;s39;s40;s41;s42;s43;s41s44;d45;s44;s47;s48;d49;s44s50;s51;d-52;s53;s54;s4s55;d56;s55;s4s58;s58;s54;s51;s49;d63;s48;s42;s40;s39;s35;s33;s70;n71;s72;s73;s74;s75;s72s76;P76;s78;P75;P74;N73;s32;s26;s24;s21;s19;d87;s18;s12;s10;s9;s5;s2d93;s94;s95;n96;s97;s98;s99;s100;s97s101;P101;s103;P100;P99;N98;/rC:6.1468,-1.536,0;7.6856,-1.4735,0;9.2875,-2.6164,0;8.0931,-2.517,0;10.0159,-1.6189,0;11.6875,-1.062,0;13.4053,-.915,0;15.1054,-1.1995,0;16.7167,-1.8035,0;18.2035,-2.6815,0;19.4751,-3.8985,0;18.3955,-4.9886,0;19.008,-6.4224,0;20.5888,-6.6577,0;20.7958,-4.9173,0;22.2156,-4.3209,0;20.0645,-7.9864,0;21.735,-8.9794,0;22.683,-7.3606,0;22.7154,-8.7357,0;20.7742,-8.5958,0;20.2515,-9.9933,0;19.657,-11.2884,0;18.8821,-12.5527,0;18.1151,-13.9079,0;18.8687,-15.2464,0;17.779,-16.3782,0;16.2279,-15.8977,0;16.5993,-14.3348,0;15.4881,-13.2685,0;14.5809,-15.6919,0;13.4361,-17.046,0;14.0156,-18.52,0;15.5384,-18.7902,0;16.2122,-17.4253,0;14.5051,-16.7642,0;12.8359,-15.6935,0;11.2967,-14.6515,0;9.9175,-13.4674,0;8.5608,-12.2918,0;7.0795,-11.2887,0;5.6315,-11.9476,0;4.4287,-10.9526,0;4.8621,-9.4239,0;6.4884,-9.772,0;7.4863,-8.5991,0;3.2264,-9.4193,0;2.2592,-8.1922,0;2.8474,-6.7772,0;4.3739,-6.621,0;5.3448,-7.882,0;6.9365,-7.7909,0;7.8872,-6.5826,0;6.4769,-5.9381,0;6.4685,-4.4448,0;7.9712,-4.0545,0;9.1512,-5.0441,0;5.5222,-3.2414,0;6.4745,-2.0623,0;3.9822,-3.2314,0;4.9885,-6.3336,0;5.985,-6.4814,0;1.9284,-5.5415,0;.3987,-5.7195,0;.7336,-8.4021,0;5.4287,-13.4742,0;9.4984,-11.0701,0;8.9116,-14.6336,0;17.7497,-17.3372,0;13.0402,-19.7117,0;13.5845,-21.1523,0;12.6091,-22.344,0;13.1534,-23.7846,0;12.178,-24.9763,0;10.6582,-24.7274,0;10.1139,-23.2868,0;11.0893,-22.0951,0;8.5942,-23.0379,0;7.6187,-24.2296,0;9.6828,-25.9191,0;12.7223,-26.4169,0;14.6732,-24.0335,0;11.9166,-16.7952,0;20.3963,-15.4411,0;17.5553,-11.7709,0;21.6059,-9.8919,0;23.0686,-5.8697,0;24.5526,-5.4582,0;22.1195,-10.4707,0;16.8828,-4.7002,0;19.1336,-1.4541,0;17.381,-.4142,0;9.605,-.0502,0;8.0626,.0566,0;7.1552,1.3009,0;7.7791,2.7088,0;6.8717,3.9531,0;5.3405,3.7895,0;4.4331,5.0338,0;5.057,6.4417,0;6.5883,6.6054,0;7.4957,5.3611,0;7.2122,8.0133,0;6.3048,9.2576,0;4.1496,7.686,0;2.9018,4.8701,0;4.7165,2.3815,0;
SMILES	CC1CC23C(/C=C/C=C(/C(C4C(OC5(C4=O)CC(C(=CC5(/C=C/C(C6C(OC7(C6=O)CC(C(=CC7(/C=C/C=C(/C(C8C(OC9(C8=O)CC(C(=CC9(/C=C/C(C(C2=O)C(O3)[O-])O)C)C=O)C)[O-])O)\C)C)CO[C@@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)C)[O-])O)C)C=O)C)[O-])O)\C)C=C1CO[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Tsunakawa; Tenmyo; Tomita; Naruse; Kotake; Miyaki; Konishi; Oki Quartromicin, a complex of novel antiviral antibiotics. I. Production, isolation, physico-chemical properties and antiviral activity Journal of Antibiotics 1992 45 (2) 180-188.
DOI	10.7164/antibiotics.45.180	PMID	1313409

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Pseudonocardiales	LPSN	85010
Family	Pseudonocardiaceae	LPSN	2070
Genus	Amycolatopsis	LPSN	1813

CLASSYFIRE

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DESCRIPTION	[[ getValue('description') ]]
KINGDOM	[[ getValue('kingdom') ]]
SUPER CLASS	[[ getValue('superclass') ]]
CLASS	[[ getValue('class') ]]
SUB CLASS	[[ getValue('subclass') ]]
MOLECULAR FRAMEWORK	[[ getValue('molecular_framework') ]]

NP CLASSIFIER

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SUPER CLASS	[[ getValue('superclass_results') ]]
CLASS	[[ getValue('class_results') ]]
PATHWAY	[[ getValue('pathway_results') ]]
IS GLYCOSIDE?	[[ getValue('isglycoside') ]]

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