SpectraBase Spectrum ID |
6NkXEEiDc8D |
Name |
6H-Dibenzo[b,d]pyran-1,9,10-triol, 6a,7,8,9,10,10a-hexahydro-6,6,9-trimethyl-3-pentyl-, 10-acetate, [6aR-(6a.alpha.,9.beta.,10a,10a.beta.)]- |
CAS Registry Number |
60948-23-4 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H34O5 |
InChI |
InChI=1S/C23H34O5/c1-6-7-8-9-15-12-17(25)20-18(13-15)28-22(3,4)16-10-11-23(5,26)21(19(16)20)27-14(2)24/h12-13,16,19,21,25-26H,6-11H2,1-5H3/t16-,19-,21+,23+/m1/s1 |
InChIKey |
PAEIGIJJBBPJFT-ZLTNCQPASA-N |
Molecular Weight |
390.520 g/mol |
SMILES |
Oc1cc(cc2c1[C@@]1([C@@]([C@](CC[C@]1(C(O2)(C)C)[H])(O)C)(OC(=O)C)[H])[H])CCCCC |
SPLASH |
splash10-0904-0097000000-e3399eee79d908cf1338 |
Source of Spectrum |
H-59-1967-11 |
Synonyms |
(6aR,9S,10S,10aR)-1,9-dihydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-10-yl acetate
10.beta.-acetoxy-1,9.alpha.-dihydroxy-3-(n-pentyl)-6,6,9.beta.-trimethyl-6a,10a-trans-6a,7,8,9,10,10a-hexahydrodibenzo[b,d]pyran |
Wiley ID |
1364965 |