Chemical Formula: | C30H50O5 |
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Molecular Weight: | 490.72 |
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Synonyms: | (23S,24R)-11B,23,24,25-Tetrahydroxydammar-13(17)-En-3-One; (8α,9β,14β,23S,24R)-11β,23,24,25-Tetrahydroxy-5α-Dammar-13(17)-En-3-One; (23S,24R)- 1β,23,24,25-Tetrahydroxy-8α,9β,14β-Dammar-13(17)-En-3-One; (8α,9β,11β,14β,23S,24R)-11,23,24,25-Tetrahydroxydammar-13(17)-En-3-One; Dammar-13(17)-En-3-One, 11, 23, 24, 25-Tetrahydroxy-, (8α,9β,11,β 14β, 23S, 24R)-; Alisol A, 98%, From Alisma Plantago-Aquatica L. |
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MDL No.: | MFCD09953906 |
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EINECS / EC No.: | N/A |
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Pubchem CID: | 15558616 |
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IUPAC Name: | (5R,8S,9S,10S,11S,14R)-11-hydroxy-4,4,8,10,14-pentamethyl-17-[(2R,4S,5R)-4,5,6-trihydroxy-6-methylheptan-2-yl]-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-3-one |
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Standard InchI: | InChI=1S/C30H50O5/c1-17(15-21(32)25(34)27(4,5)35)18-9-13-29(7)19(18)16-20(31)24-28(6)12-11-23(33)26(2,3)22(28)10-14-30(24,29)8/h17,20-22,24-25,31-32,34-35H,9-16H2,1-8H3/t17-,20+,21+,22+,24+,25-,28+,29+,30+/m1/s1 |
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InchI Key: | HNOSJVWYGXOFRP-UNPOXIGHSA-N |
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SMILES: | CC(CC(C(C(C)(C)O)O)O)C1=C2CC(C3C4(CCC(=O)C(C4CCC3(C2(CC1)C)C)(C)C)C)O |
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Appearance: | - |
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Melting Point: | N/A |
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Boiling Point: | 629.302 °C at 760 mmHg |
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Density (Theoretical): | 1.14 |
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