
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 151519-50-5 |
| Catalog No. | 2A-1177295 |
| Chinese Name | 7-O-Demethyl rapamycin |
| Synonyms | 7-O-Demethyl Cypher |
| Molecular Formula | C50H77NO13 |
| Molecular Weight | 1816.69 |
| Purity | ≥90 (HPLC) |
| Appearance | powder |
| Storage Condition | 2-8°C, sealed, dry |
| Application | 7-O-Demethyl rapamycin is a derivative of rapamycin (HY-10219) with antifungal activity and immunosuppressive effects. 7-O-Demethyl rapamycin can effectively inhibit the growth of tumor cells. |
| SMILES | O=C([C@@]1([H])NC([C@](C2)([H])NC([C@@H](C3=CC(OC4=CC1=C(Cl)C(O)=C4)=C(O)C=C3)NC)=O)=O)N[C@@](C5=CC(OC6=CC=C2C=C6)=C(O[C@H]7[C@H](NC(CCCCCCCCC(C)C)=O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)O7)C(OC8=C(Cl)C=C([C@@]9([H])O)C=C8)=C5)([H])C(N[C@@]%10([H])C(N[C@]9([H]) |
| InChI | 1S/C88H100Cl2N10O28/c1-38(2)13-10-8-7-9-11-14-61(106)93-69-73(109)75(111)78(86(120)121)128-87(69)127-77-58-31-43-32-59(77)124-55-24-19-42(29-50(55)89)71(107)68-84(118)97-66(80(114)91-25-12-26-99(3)4)48-33-44(102)34-57(125-88-76(112)74(110)72(108)60(37-101)126-88)62(48)47-28-40(17-22-52(47)103)64(81(115)98-68)94-82(116)65(43)95-83(117)67-49-35-46(36-54(105)63(49)90)123-56-30-41(18-23-53(56)104)70(100(5)6)85(119)92-51(79(113)96-67)27-39-15-20-45(122-58)21-16-39/h15-24,28-36,38,51,60,64-76,78,87-88,101-105,107-112H,7-14,25-27,37H2,1-6H3,(H,91,114)(H,92,119)(H,93,106)(H,94,116)(H,95,117)(H,96,113)(H,97,118)(H,98,115)(H,120,121)/t51-,60-,64-,65-,66+,67+,68+,69-,70-,71-,72-,73-,74+,75+,76+,78+,87?,88+/m1/s1 |
| InChI Key | NECNEVHRBQBTTH-SOWMDMGUSA-N |
| NACRES Code | NA.77 |
| UNSPSC | 12352200 |
| MSDS | msds/177862_1_151519_50_5.pdf |
| Transport Info | Product name: 7-O-Demethyl rapamycin |
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