Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA014320
PROPERTIES
NPAID | NPA014320 |
---|---|
CLUSTER ID | 1788 |
NODE ID | 1182 |
NAME | Galacardin A |
FORMULA | C101H121Cl2N9O46 |
MOLECULAR WEIGHT (Da) | 2268.0020 |
ACCURATE MASS (Da) | 2265.6783 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Saccharothrix |
ORIGIN SPECIES | sp. SANK 64289 |
InChIKey | VZHGBVYVAUUUAQ-UHFFFAOYSA-N |
InChI | InChI=1S/C101H121Cl2N9O46/c1-32-70(120)48(104)26-60(143-32)154-87-39-11-18-52(47(103)21-39)148-55-23-40-22-54(88(55)158-101-89(79(129)75(125)59(31-116)153-101)155-61-27-49(105)71(121)33(2)144-61)146-42-14-7-36(8-15-42)86(157-100-83(133)78(128)74(124)58(30-115)152-100)68(111-90(135)63(106-4)35-5-12-43(13-6-35)147-97-84(134)80(130)85(34(3)145-97)156-99-82(132)77(127)73(123)57(29-114)151-99)94(139)108-65(38-10-17-53(46(102)20-38)149-98-81(131)76(126)72(122)56(28-113)150-98)91(136)109-66(40)93(138)107-64-37-9-16-50(118)44(19-37)62-45(24-41(117)25-51(62)119)67(96(141)142)110-95(140)69(87)112-92(64)137/h5-25,32-34,48-49,56-61,63-87,89,97-101,106,113-134H,26-31,104-105H2,1-4H3,(H,107,138)(H,108,139)(H,109,136)(H,110,140)(H,111,135)(H,112,137)(H,141,142) |
SMILES | CC1C(C(CC(O1)OC2C(C(C(OC2OC3=C4C=C5C=C3OC6=C(C=C(C=C6)C(C7C(=O)NC(C8=CC(=CC(=C8C9=C(C=CC(=C9)C(C(=O)N7)NC(=O)C5NC(=O)C(NC(=O)C(C(C1=CC=C(O4)C=C1)OC1C(C(C(C(O1)CO)O)O)O)NC(=O)C(C1=CC=C(C=C1)OC1C(C(C(C(O1)C)OC1C(C(C(C(O1)CO)O)O)O)O)O)NC)C1=CC(=C(C=C1)OC1C(C(C(C(O1)CO)O)O)O)Cl)O)O)O)C(=O)O)OC1CC(C(C(O1)C)O)N)Cl)CO)O)O)N)O |
ORIGINAL ISOLATION REFERENCE
CITATION | TAKEUCHI, MICHIKO; TAKAHASHI, SHUJI; ENOKITA, RYUZO; SAKAIDA, YOSHIHARU; HARUYAMA, HIDEYUKI; NAKAMURA, TAKEMICHI; KATAYAMA, TOSHIAKI; INUKAI, MASATOSHI Galacardins A and B, new glycopeptide antibiotics Journal of Antibiotics 1992 45 (3) 297-305. | ||
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DOI | 10.7164/antibiotics.45.297 | PMID | 1577657 |