| 标准英文名 | |
|---|---|
| Cas No. | 149633-74-9 |
| 别名 | α-D-Glucopyranuronamide, O-[N-(2-hydroxy-5-oxo-1-cyclopenten-1-yl)-β-D-galactopyranuronamidosyl]-(1→4)-O-2-(acetylamino)-2,6-dideoxy-β-D-glucopyranosyl-(1→4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1→2)-4-C-methyl-, 3-carbamate 1-[(2R)-2-carboxy-2-[[(2Z,6E,13E)-3,8,8,14,18-pentamethyl-11-methylene-2,6,13,17-nonadecatetraen-1-yl]oxy]ethyl hydrogen phosphate] |
| 标准Smiles | CC(C)(CCC(=C)CC=C(C)CCC=C(C)C)C=CCCC(C)=CCOC(COP(O)(=O)OC1OC(C(N)=O)C(C)(O)C(OC(N)=O)C1OC1OC(CO)C(OC2OC(C)C(OC3OC(C(O)C(O)C3O)C(=O)NC3C(=O)CCC=3O)C(O)C2NC(C)=O)C(O)C1NC(C)=O)C(O)=O |
| MDL No. | |
| 精确分子量 | 1,419.60852 |
| Smiles | O=C(OC1C(OC2OC(CO)C(OC3OC(C)C(OC4OC(C(=O)NC=5C(=O)CCC5O)C(O)C(O)C4O)C(O)C3NC(=O)C)C(O)C2NC(=O)C)C(OC(C(=O)N)C1(O)C)OP(=O)(O)OCC(OCC=C(C)CCC=CC(C)(C)CCC(=C)CC=C(C)CCC=C(C)C)C(=O)O)N |
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| Inchi | InChI=1S/C63H98N5O29P/c1-29(2)15-14-17-30(3)18-19-32(5)22-25-62(9,10)24-13-12-16-31(4)23-26-87-39(56(81)82)28-88-98(85,86)97-60-51(52(96-61(65)83)63(11,84)53(95-60)54(64)79)94-58-42(67-35(8)71)44(75)49(38(27-69)90-58)92-57-41(66-34(7)70)43(74)48(33(6)89-57)91-59-47(78)45(76)46(77)50(93-59)55(80)68-40-36(72)20-21-37(40)73/h13,15,18,23-24,33,38-39,41-53,57-60,69,72,74-78,84H,5,12,14,16-17,19-22,25-28H2,1-4,6-11H3,(H2,64,79)(H2,65,83)(H,66,70)(H,67,71)(H,68,80)(H,81,82)(H,85,86) |
| InchiKey | DEPVRFHILVDIDE-UHFFFAOYSA-N |
| 备注 |
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