4H-Phenanthro[10,1-bc]furan-4-one, 1,2,3,3a,5a,7,8,9,10,10a,10b,10c-dodecahydro-10a-hydroxy-3a,8,10b-trimethyl-8-[2-(sulfooxy)ethyl]-, (3aS,5aR,8S,10aR,10bS,10cR)-
CAS Registry Number®
109621-33-2
CAS Name
4H-Phenanthro[10,1-bc]furan-4-one, 1,2,3,3a,5a,7,8,9,10,10a,10b,10c-dodecahydro-10a-hydroxy-3a,8,10b-trimethyl-8-[2-(sulfooxy)ethyl]-, (3aS,5aR,8S,10aR,10bS,10cR)-Molecular Formula
C20H30O7SMolecular Mass
414.51Cite this Page
4H-Phenanthro[10,1-bc]furan-4-one, 1,2,3,3a,5a,7,8,9,10,10a,10b,10c-dodecahydro-10a-hydroxy-3a,8,10b-trimethyl-8-[2-(sulfooxy)ethyl]-, (3aS,5aR,8S,10aR,10bS,10cR)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=109621-33-2 (retrieved ) (CAS RN: 109621-33-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C20H30O7S/c1-17(9-10-26-28(23,24)25)7-8-20(22)13(12-17)11-14-15-18(2,16(21)27-14)5-4-6-19(15,20)3/h11,14-15,22H,4-10,12H2,1-3H3,(H,23,24,25)/t14-,15+,17-,18+,19+,20-/m1/s1
InChIKey
InChIKey=ITEVFNFZADKMQH-QBUATURESA-N
SMILES
C[C@]12[C@]3([C@@](C=C4[C@]1(O)CC[C@@](CCOS(=O)(=O)O)(C)C4)(OC(=O)[C@@]3(C)CCC2)[H])[H]
Canonical SMILES
O=C1OC2C=C3CC(C)(CCOS(=O)(=O)O)CCC3(O)C4(C)CCCC1(C)C24
Other Names for this Substance
- 4H-Phenanthro[10,1-bc]furan-4-one, 1,2,3,3a,5a,7,8,9,10,10a,10b,10c-dodecahydro-10a-hydroxy-3a,8,10b-trimethyl-8-[2-(sulfooxy)ethyl]-, (3aS,5aR,8S,10aR,10bS,10cR)-
- 4H-Phenanthro[10,1-bc]furan-4-one, 1,2,3,3a,5a,7,8,9,10,10a,10b,10c-dodecahydro-10a-hydroxy-3a,8,10b-trimethyl-8-[2-(sulfooxy)ethyl]-, [3aS-(3aα,5aα,8α,10aα,10bβ,10cα)]-
- Hymatoxin A