anti-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrobenzo(c)phenanthrene
(3R,5S,6S,7R)-4-oxapentacyclo[9.8.0.02,8.03,5.014,19]nonadeca-1(11),2(8),9,12,14,16,18-heptaene-6,7-diol
Also Known As: BcPhde|(-)-anti-BPhDE|(-)-anti-B[c]PDE|KST-1A8664|Benzo(c)phenanthrene 3,4-diol-1,2-epoxide-2|anti-Benzo(c)phenanthrene-3,4-diol-1,2-oxide|(+)-Benzo(c)phenanthrene-3,4-diol-1,2-epoxide-2|(-)-Benzo(c)phenanthrene-3,4-diol-1,2-epoxide (anti)|anti-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrobenzo(c)phenanthrene|anti-Benzo(c)phenanthrene-3,4-dihydrodiol-1,2-epoxide|(+)-anti-benzo(c)phenanthrene-3,4-dihydrodiol-1,2-epoxide|(-)-anti-benzo(c)phenanthrene 3,4-dihydrodiol-1,2-epoxide|(1as,2s,3r,11dr)-1a,2,3,11d-tetrahydrobenzo[5,6]phenanthro[3,4-b]oxirene-2,3-diol|r-4,t-3-Dihydroxy-c-1,2-oxy-1,2,3,4-tetrahydrobenzo(c)phenanthrene|Benzo(5,6)phenanthro(3,4-b)oxirene-5,6-diol, 5,6,6a,7a-tetrahydro-, (5R,6S,6aS,7aR)-rel-|Benzo(5,6)phenanthro(3,4-b)oxirene-2,3-diol, 1a,2,3,11d-tetrahydro-, (1a-alpha,2-beta,3-alpha,11d-alpha)-(+-)-|Benzo(5,6)phenanthro(3,4-b)oxirene-2,3-diol, 1a,2,3,11d-tetrahydro-, (1aS,2S,3R,11dR)-|trans-1-alpha,2-alpha-Epoxy-1,2,3,4-tetrahydrobenzo(c)phenanthrene-3-alpha,4-beta-diol|(1aS-(1aalpha,2beta,3alpha,11dalpha))-1a,2,3,11d-tetrahydrobenzo(5,6)phenanthro(3,4-b)oxirene-2,3-diol|1beta,2beta-Epoxy-1,2,3,4-tetrahydrobenzo[c]phenanthrene-3beta,4alpha-diol|Benzo(5,6)phenanthro(3,4-b)oxirene-2,3-diol, 1a,2,3,11d-tetrahydro-, (1aalpha,2beta,3alpha,11dalpha)-|Benzo(5,6)phenanthro(3,4-b)oxirene-2,3-diol, 1a,2,3,11d-tetrahydro-, (1aS-(1a-alpha,2-beta,3-alpha,11d-alpha))-|(1R)-1,2,3,4-Tetrahydro-1beta,2beta-epoxybenzo[c]phenanthrene-3beta,4alpha-diol|(1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrobenzo[c]phenanthrene|(1AS-(1AALPHA,2BETA,3ALPHA,11DALPHA))-1A,2,3,11D-TETRAHYDROBENZO[5,6]PHENANTHRO[3,4-B]OXIRENE-2,3-DI OL|(3R,5S,6S,7R)-4-oxapentacyclo[9.8.0.02,8.03,5.014,19]nonadeca-1,8,10,12,14,16,18-heptaene-6,7-diol
| Molecular Formula | C18H14O3 |
|---|---|
| Molecular Weight | 278.0943 g/mol |
| LogP | 2.84 |
| Topological Polar Surface Area | 52.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 278.0943 |
| Heavy Atoms | 21 |
| Complexity | 886.2 |
Chemical Identifiers
| CAS Number | 75443-72-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C4=C(C=C3)[C@H]([C@@H]([C@H]5[C@@H]4O5)O)O |
Product Overview
anti-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrobenzo(c)phenanthrene (CAS 75443-72-0), with molecular formula C18H14O3 and molecular weight 278.0943 g/mol. IUPAC: (3R,5S,6S,7R)-4-oxapentacyclo[9.8.0.02,8.03,5.014,19]nonadeca-1(11),2(8),9,12,14,16,18-heptaene-6,7-diol.
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