Molecular Structure:
CCD No.:CCD00176458
VALTRATE
CAS No.:
18296-44-1
Formula:C22 H30 O8
MolWeight:422.471
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| Product Name： | VALTRATE |
| CAS： | 18296-44-1 |
| English Synonyms： | VALTRATE ; VALEPOTRIATE ; VALTRATUM ; HALAZUCHROME B ; BALDRISEDON |
| MDL Number.： | MFCD00868024 |
| H bond acceptor： | 8 |
| H bond donor： | 0 |
| Smile： | CC(C)CC(=O)O[C@H]1C=C2[C@@H]([C@@]13CO3)[C@@H](OC=C2COC(=O)C)OC(=O)CC(C)C |
| InChi： | InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1 |
| InChiKey： | InChIKey=BDIAUFOIMFAIPU-KVJIRVJXSA-N |
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