Basic Information |
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Product Name: | MYROTOXIN B |
CAS: | 99486-49-4 |
English Synonyms: | MYROTOXIN B |
MDL Number.: | MFCD01684324 |
H bond acceptor: | 11 |
H bond donor: | 1 |
Smile: | CC1=CC2C3(CC1OC(=O)C)COC(=O)C4C5(O4)CCO/C(=C\C/C=C\C(=O)OC6[C@]3(C7(CO7)[C@@H](C6)O2)C)/C5O |
InChi: | InChI=1S/C29H34O11/c1-15-10-20-27(12-18(15)37-16(2)30)13-35-25(33)24-28(40-24)8-9-34-17(23(28)32)6-4-5-7-22(31)39-19-11-21(38-20)29(14-36-29)26(19,27)3/h5-7,10,18-21,23-24,32H,4,8-9,11-14H2,1-3H3/b7-5-,17-6-/t18?,19?,20?,21-,23?,24?,26-,27?,28?,29?/m1/s1 |
InChiKey: | InChIKey=BDPRKFBFVAVFJK-AYRCKKLXSA-N |
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